Benzene and substituted derivatives
Benzene and substituted derivatives
Filtered Search Results
Benzyl Alcohol, 99%, Pure, Thermo Scientific Chemicals
CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
PubChem CID | 244 |
---|---|
CAS | 100-51-6 |
Molecular Weight (g/mol) | 108.14 |
ChEBI | CHEBI:17987 |
MDL Number | MFCD00004599,MFCD03792087 |
SMILES | OCC1=CC=CC=C1 |
Synonym | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
IUPAC Name | phenylmethanol |
InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
Molecular Formula | C7H8O |
Tetrakis(triphenylphosphine)palladium(0), 99%, Thermo Scientific Chemicals
CAS: 14221-01-3 Molecular Formula: C72H60P4Pd Molecular Weight (g/mol): 1155.59 MDL Number: MFCD00010012 InChI Key: NFHFRUOZVGFOOS-UHFFFAOYSA-N Synonym: tetrakis triphenylphosphine palladium,tetrakis triphenylphosphine palladium 0,pd pph3 4,tetrakis triphenylphosphine palladium o,tetra triphenylphosphine palladium,palladium-tetrakis triphenylphosphine,palladium 0 tetrakis triphenylphosphine,palladium, tetrakis triphenylphosphine-, t-4 PubChem CID: 11979704 IUPAC Name: palladium;triphenylphosphane SMILES: [Pd].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
PubChem CID | 11979704 |
---|---|
CAS | 14221-01-3 |
Molecular Weight (g/mol) | 1155.59 |
MDL Number | MFCD00010012 |
SMILES | [Pd].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
Synonym | tetrakis triphenylphosphine palladium,tetrakis triphenylphosphine palladium 0,pd pph3 4,tetrakis triphenylphosphine palladium o,tetra triphenylphosphine palladium,palladium-tetrakis triphenylphosphine,palladium 0 tetrakis triphenylphosphine,palladium, tetrakis triphenylphosphine-, t-4 |
IUPAC Name | palladium;triphenylphosphane |
InChI Key | NFHFRUOZVGFOOS-UHFFFAOYSA-N |
Molecular Formula | C72H60P4Pd |
2-Phenoxyethanol, 99%, Thermo Scientific Chemicals
CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO
PubChem CID | 31236 |
---|---|
CAS | 122-99-6 |
Molecular Weight (g/mol) | 138.17 |
ChEBI | CHEBI:64275 |
MDL Number | MFCD00002857 |
SMILES | C1=CC=C(C=C1)OCCO |
Synonym | phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane |
IUPAC Name | 2-phenoxyethanol |
InChI Key | QCDWFXQBSFUVSP-UHFFFAOYSA-N |
Molecular Formula | C8H10O2 |
Sodium Salicylate, 99%, Thermo Scientific Chemicals
CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.104 MDL Number: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
PubChem CID | 16760658 |
---|---|
CAS | 54-21-7 |
Molecular Weight (g/mol) | 160.104 |
ChEBI | CHEBI:9180 |
MDL Number | MFCD00002440 |
SMILES | C1=CC=C(C(=C1)C(=O)[O-])O.[Na+] |
Synonym | sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl |
IUPAC Name | sodium;2-hydroxybenzoate |
InChI Key | ABBQHOQBGMUPJH-UHFFFAOYSA-M |
Molecular Formula | C7H5NaO3 |
trans-Anethole, 99%, Thermo Scientific Chemicals
CAS: 4180-23-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.2 MDL Number: MFCD00009284 InChI Key: RUVINXPYWBROJD-ONEGZZNKSA-N Synonym: anethole,trans-anethole,e-anethole,4-propenylanisole,anise camphor,trans-anethol,isoestragole,e-1-methoxy-4-prop-1-en-1-yl benzene,anethol,p-anethole PubChem CID: 637563 ChEBI: CHEBI:35616 IUPAC Name: 1-methoxy-4-[(E)-prop-1-enyl]benzene SMILES: CC=CC1=CC=C(C=C1)OC
PubChem CID | 637563 |
---|---|
CAS | 4180-23-8 |
Molecular Weight (g/mol) | 148.2 |
ChEBI | CHEBI:35616 |
MDL Number | MFCD00009284 |
SMILES | CC=CC1=CC=C(C=C1)OC |
Synonym | anethole,trans-anethole,e-anethole,4-propenylanisole,anise camphor,trans-anethol,isoestragole,e-1-methoxy-4-prop-1-en-1-yl benzene,anethol,p-anethole |
IUPAC Name | 1-methoxy-4-[(E)-prop-1-enyl]benzene |
InChI Key | RUVINXPYWBROJD-ONEGZZNKSA-N |
Molecular Formula | C10H12O |
p-Toluenesulfonamide, 99%, Thermo Scientific Chemicals
CAS: 70-55-3 Molecular Formula: C7H9NO2S Molecular Weight (g/mol): 171.21 MDL Number: MFCD00011692 InChI Key: LMYRWZFENFIFIT-UHFFFAOYSA-N Synonym: p-toluenesulfonamide,4-toluenesulfonamide,tosylamide,p-tosylamide,benzenesulfonamide, 4-methyl,p-tolylsulfonamide,toluene-4-sulfonamide,tolylsulfonamide,4-methylbenzene-1-sulfonamide,p-toluenesulfamide PubChem CID: 6269 ChEBI: CHEBI:34435 IUPAC Name: 4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N
PubChem CID | 6269 |
---|---|
CAS | 70-55-3 |
Molecular Weight (g/mol) | 171.21 |
ChEBI | CHEBI:34435 |
MDL Number | MFCD00011692 |
SMILES | CC1=CC=C(C=C1)S(=O)(=O)N |
Synonym | p-toluenesulfonamide,4-toluenesulfonamide,tosylamide,p-tosylamide,benzenesulfonamide, 4-methyl,p-tolylsulfonamide,toluene-4-sulfonamide,tolylsulfonamide,4-methylbenzene-1-sulfonamide,p-toluenesulfamide |
IUPAC Name | 4-methylbenzenesulfonamide |
InChI Key | LMYRWZFENFIFIT-UHFFFAOYSA-N |
Molecular Formula | C7H9NO2S |
DL-α-Methoxyphenylacetic acid, 99%, Thermo Scientific Chemicals
CAS: 7021-09-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 InChI Key: DIWVBIXQCNRCFE-UHFFFAOYNA-N Synonym: methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid PubChem CID: 107202 IUPAC Name: 2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O
PubChem CID | 107202 |
---|---|
CAS | 7021-09-2 |
Molecular Weight (g/mol) | 166.18 |
SMILES | COC(C1=CC=CC=C1)C(=O)O |
Synonym | methoxyphenylacetic acid,methoxy phenyl acetic acid,dl-alpha-methoxyphenylacetic acid,acetic acid, methoxyphenyl,alpha-methoxyphenylacetic acid,o-methyl-dl-mandelic acid,benzeneacetic acid, .alpha.-methoxy,2-methoxy-2-phenyl-acetic acid,methyloxy phenyl acetic acid,.alpha.-methoxyphenylacetic acid |
IUPAC Name | 2-methoxy-2-phenylacetic acid |
InChI Key | DIWVBIXQCNRCFE-UHFFFAOYNA-N |
Molecular Formula | C9H10O3 |
Benzyl bromide, 99%, Thermo Scientific Chemicals
CAS: 100-39-0 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.037 MDL Number: MFCD00000172 InChI Key: AGEZXYOZHKGVCM-UHFFFAOYSA-N Synonym: benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite PubChem CID: 7498 ChEBI: CHEBI:59858 IUPAC Name: bromomethylbenzene SMILES: C1=CC=C(C=C1)CBr
PubChem CID | 7498 |
---|---|
CAS | 100-39-0 |
Molecular Weight (g/mol) | 171.037 |
ChEBI | CHEBI:59858 |
MDL Number | MFCD00000172 |
SMILES | C1=CC=C(C=C1)CBr |
Synonym | benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite |
IUPAC Name | bromomethylbenzene |
InChI Key | AGEZXYOZHKGVCM-UHFFFAOYSA-N |
Molecular Formula | C7H7Br |
Propyl 4-hydroxybenzoate, 99+%, Thermo Scientific Chemicals
CAS: 94-13-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.2 MDL Number: MFCD00002354 InChI Key: QELSKZZBTMNZEB-UHFFFAOYSA-N Synonym: propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept PubChem CID: 7175 ChEBI: CHEBI:32063 IUPAC Name: propyl 4-hydroxybenzoate SMILES: CCCOC(=O)C1=CC=C(C=C1)O
PubChem CID | 7175 |
---|---|
CAS | 94-13-3 |
Molecular Weight (g/mol) | 180.2 |
ChEBI | CHEBI:32063 |
MDL Number | MFCD00002354 |
SMILES | CCCOC(=O)C1=CC=C(C=C1)O |
Synonym | propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept |
IUPAC Name | propyl 4-hydroxybenzoate |
InChI Key | QELSKZZBTMNZEB-UHFFFAOYSA-N |
Molecular Formula | C10H12O3 |
Triphenylphosphine, 99%, Thermo Scientific Chemicals
CAS: 603-35-0 Molecular Formula: C18H15P Molecular Weight (g/mol): 262.29 MDL Number: MFCD00003043 MFCD20489348 InChI Key: RIOQSEWOXXDEQQ-UHFFFAOYSA-N Synonym: triphenylphosphine,triphenyl phosphine,phosphine, triphenyl,triphenylphosphorus,triphenyl-phosphane,triphenylphosphide,phosphorustriphenyl,trifenylfosfin,trifenylfosfin czech,triphenylphosphine resin PubChem CID: 11776 IUPAC Name: triphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
PubChem CID | 11776 |
---|---|
CAS | 603-35-0 |
Molecular Weight (g/mol) | 262.29 |
MDL Number | MFCD00003043 MFCD20489348 |
SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
Synonym | triphenylphosphine,triphenyl phosphine,phosphine, triphenyl,triphenylphosphorus,triphenyl-phosphane,triphenylphosphide,phosphorustriphenyl,trifenylfosfin,trifenylfosfin czech,triphenylphosphine resin |
IUPAC Name | triphenylphosphane |
InChI Key | RIOQSEWOXXDEQQ-UHFFFAOYSA-N |
Molecular Formula | C18H15P |
Phthaldialdehyde, 98%, Thermo Scientific Chemicals
CAS: 643-79-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00003335 InChI Key: ZWLUXSQADUDCSB-UHFFFAOYSA-N Synonym: o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde PubChem CID: 4807 ChEBI: CHEBI:70851 IUPAC Name: phthalaldehyde SMILES: O=CC1=CC=CC=C1C=O
PubChem CID | 4807 |
---|---|
CAS | 643-79-8 |
Molecular Weight (g/mol) | 134.13 |
ChEBI | CHEBI:70851 |
MDL Number | MFCD00003335 |
SMILES | O=CC1=CC=CC=C1C=O |
Synonym | o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde |
IUPAC Name | phthalaldehyde |
InChI Key | ZWLUXSQADUDCSB-UHFFFAOYSA-N |
Molecular Formula | C8H6O2 |
3-Chloroperoxybenzoic acid, 70-75%, balance 3-Chlorobenzoic acid and water, Thermo Scientific Chemicals
3-Chloroperoxybenzoic acid, 70-75%, C7H5ClO3, CAS Number-937-14-4, 535-80-8, 7732-18-5
Linear Formula | ClC6H4CO3H |
---|---|
Molecular Weight (g/mol) | 172.56 |
ChEBI | CHEBI:52091 |
CAS Min % | 25.0 |
InChI Key | NHQDETIJWKXCTC-UHFFFAOYSA-N |
Density | 0.5600g/mL |
PubChem CID | 70297 |
Name Note | 70 - 75% |
Percent Purity | 70-75% |
Fieser | 01,135; 02,68; 03,49; 04,85; 05,120; 06,110; 07,62; 08,97; 09,108; 10,92; 11,122; 12,118; 13,76; 15,86; 16,80; 17,76 |
RTECS Number | SD9470000 |
Formula Weight | 172.57 |
Melting Point | 92.0°C to 94.0°C |
CAS Max % | 30.0 |
Color | White |
Physical Form | Moist Powder |
SMILES | OOC(=O)C1=CC=CC(Cl)=C1 |
Merck Index | 15,2154 |
Assay Percent Range | di-m-Chlorobenzoyl peroxide: < 0.1% Typical (HPLC) |
CAS | 7732-18-5 |
Health Hazard 3 | GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. Keep away from heat/sparks/open flames/hot surfaces. - No smoking. Keep/Store away from clothing/ combustible materials. IF SWALLOWED: rin |
MDL Number | MFCD00002127 |
Health Hazard 2 | GHS H Statement Causes severe skin burns and eye damage. Harmful if swallowed. Heating may cause a fire. |
Solubility Information | Solubility in water: insoluble. Other solubilities: soluble in koh, soluble in chloroform and acetone |
Health Hazard 1 | GHS Signal Word: Danger |
Synonym | 3-chloroperoxybenzoic acid,3-chloroperbenzoic acid,mcpba,m-chloroperbenzoic acid,m-chloroperoxybenzoic acid,meta-chloroperoxybenzoic acid,benzenecarboperoxoic acid, 3-chloro,m-chlorobenzoyl hydroperoxide,meta-chloroperbenzoic acid,3-chlorobenzoperoxoic acid |
TSCA | TSCA |
IUPAC Name | 3-chlorobenzenecarboperoxoic acid |
Beilstein | 09,IV,972 |
Molecular Formula | C7H5ClO3 |
EINECS Number | 213-322-3 |
Specific Gravity | 0.56 |
Styrene, 99.5%, for analysis, stabilized, Thermo Scientific Chemicals
CAS: 100-42-5 Molecular Formula: C8H8 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00008612,MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N Synonym: ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene PubChem CID: 7501 ChEBI: CHEBI:27452 IUPAC Name: styrene SMILES: C=CC1=CC=CC=C1
PubChem CID | 7501 |
---|---|
CAS | 100-42-5 |
Molecular Weight (g/mol) | 104.15 |
ChEBI | CHEBI:27452 |
MDL Number | MFCD00008612,MFCD00084450 |
SMILES | C=CC1=CC=CC=C1 |
Synonym | ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene |
IUPAC Name | styrene |
InChI Key | PPBRXRYQALVLMV-UHFFFAOYSA-N |
Molecular Formula | C8H8 |
3-Aminobenzoic acid, 99+%, Thermo Scientific Chemicals
CAS: 99-05-8 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00007795 InChI Key: XFDUHJPVQKIXHO-UHFFFAOYSA-N Synonym: m-aminobenzoic acid,m-carboxyaniline,benzoic acid, 3-amino,3-carboxyaniline,maba,benzoic acid, m-amino,aniline-3-carboxylic acid,meta-aminobenzoic acid,m-aminobenzoesaeure,unii-g2x3b3o37u PubChem CID: 7419 ChEBI: CHEBI:42682 IUPAC Name: 3-aminobenzoic acid SMILES: C1=CC(=CC(=C1)N)C(=O)O
PubChem CID | 7419 |
---|---|
CAS | 99-05-8 |
Molecular Weight (g/mol) | 137.14 |
ChEBI | CHEBI:42682 |
MDL Number | MFCD00007795 |
SMILES | C1=CC(=CC(=C1)N)C(=O)O |
Synonym | m-aminobenzoic acid,m-carboxyaniline,benzoic acid, 3-amino,3-carboxyaniline,maba,benzoic acid, m-amino,aniline-3-carboxylic acid,meta-aminobenzoic acid,m-aminobenzoesaeure,unii-g2x3b3o37u |
IUPAC Name | 3-aminobenzoic acid |
InChI Key | XFDUHJPVQKIXHO-UHFFFAOYSA-N |
Molecular Formula | C7H7NO2 |
2,6-Di-tert-butyl-4-methylphenol, 99%, Thermo Scientific Chemicals
CAS: 128-37-0 Molecular Formula: C15H24O Molecular Weight (g/mol): 220.356 MDL Number: MFCD00011644 InChI Key: NLZUEZXRPGMBCV-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
PubChem CID | 31404 |
---|---|
CAS | 128-37-0 |
Molecular Weight (g/mol) | 220.356 |
ChEBI | CHEBI:34247 |
MDL Number | MFCD00011644 |
SMILES | CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C |
Synonym | 2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht |
IUPAC Name | 2,6-ditert-butyl-4-methylphenol |
InChI Key | NLZUEZXRPGMBCV-UHFFFAOYSA-N |
Molecular Formula | C15H24O |