Benzoyl derivatives

Dextran sulfate sodium salt (36,000-50,000 M.Wt), MP Grade, MP Biomedicals™

CAS: 9011-18-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 InChI Key: BLFLLBZGZJTVJG-UHFFFAOYSA-N Synonym: benzocaine, ethyl aminobenzoate, ethyl p-aminobenzoate, americaine, anesthesin, anaesthesin, ethoform, norcaine, orthesin, parathesin PubChem CID: 2337 ChEBI: CHEBI:116735 IUPAC Name: ethyl 4-aminobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)N

Alfa Aesar™ Ethyl mesitylglyoxylate, 97%

CAS: 5524-57-2 Molecular Formula: C13H16O3 Molecular Weight (g/mol): 220.268 MDL Number: MFCD00151821 InChI Key: XRSPPFOBPRPYLD-UHFFFAOYSA-N Synonym: ethyl mesitylglyoxylate, ethyl 2-mesityl-2-oxoacetate, ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate, acmc-1asq7, mesitylglyoxylic acid ethyl ester, ethyl 2,4,6-trimethylphenyl glyoxylate, alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester PubChem CID: 2736481 IUPAC Name: ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate SMILES: CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C

Alfa Aesar™ 2-Bromo-4-methoxybenzaldehyde, 98%

CAS: 43192-31-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD09788636 InChI Key: ODISAUHBLBVQKC-UHFFFAOYSA-N Synonym: benzaldehyde, 2-bromo-4-methoxy, benzaldehyde,2-bromo-4-methoxy, 3-bromo-4-formylanisole, 2-bromo-p-anisaldehyde, pubchem12556, acmc-209jtd, ksc232o5d, 2-bromanyl-4-methoxy-benzaldehyde PubChem CID: 11127641 IUPAC Name: 2-bromo-4-methoxybenzaldehyde SMILES: COC1=CC(=C(C=C1)C=O)Br

Alfa Aesar™ 3-(4-Methoxybenzoyl)acrylic acid, 98%

CAS: 5711-41-1 Molecular Formula: C11H10O4 Molecular Weight (g/mol): 206.197 MDL Number: MFCD00020486 InChI Key: WORYXBDHTBWLLL-VOTSOKGWSA-N Synonym: 3-4-methoxybenzoyl acrylic acid, 4-4-methoxyphenyl-4-oxobut-2-enoic acid, 2e-4-4-methoxyphenyl-4-oxobut-2-enoic acid, 3-p-methoxybenzoyl acrylic acid, acrylic acid, 3-p-methoxybenzoyl, trans-3-4-methoxybenzoyl acrylic acid, e-4-4-methoxyphenyl-4-oxobut-2-enoic acid, gamma-oxo-4-methoxybenzenecrotonic acid, 4-4-methoxyphenyl-4-oxo-buten-2-saeure, 4-4-methoxyphenyl-4-oxo-2-butenoic acid PubChem CID: 5355095 IUPAC Name: (E)-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid SMILES: COC1=CC=C(C=C1)C(=O)C=CC(=O)O

3-chloro-5-fluorobenzaldehyde, 97%, ACROS Organics™

CAS: 90390-49-1 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 MDL Number: MFCD02261734 InChI Key: QWBYWPJNPKGEBO-UHFFFAOYSA-N Synonym: 3-chloro-5-fluoro-benzaldehyde, 5-chloro-3-fluorobenzaldehyde, benzaldehyde, 3-chloro-5-fluoro, pubchem2890, salor-int l300993-1ea, ksc494e8p, 3-chloro-5-fluorobenzaldehyde PubChem CID: 2734839 IUPAC Name: 3-chloro-5-fluorobenzaldehyde SMILES: C1=C(C=C(C=C1F)Cl)C=O

2-Fluoro-5-formylbenzonitrile, 99%, ACROS Organics™

CAS: 218301-22-5 Molecular Formula: C8H4FNO Molecular Weight (g/mol): 149.12 MDL Number: MFCD01863558 InChI Key: MOFRJTLODZILCR-UHFFFAOYSA-N Synonym: 3-cyano-4-fluorobenzaldehyde, 4-fluoro-3-cyanobenzaldehyde, 2-fluoro-5-formyl-benzonitrile, benzonitrile, 2-fluoro-5-formyl, 2-fluoro-5-formylbenzenecarbonitrile, 2-fluor-5-formylbenzonitrile, 10014 2-fluoro-5-formyl benzonitrile, pubchem2252, acmc-1cfa9, fluoro-5-formylbenzonitrile PubChem CID: 2769582 IUPAC Name: 2-fluoro-5-formylbenzonitrile SMILES: C1=CC(=C(C=C1C=O)C#N)F

3-chlorobenzaldehyde, 99%, ACROS Organics™

CAS: 587-04-2 Molecular Formula: C7H5ClO Molecular Weight (g/mol): 140.57 MDL Number: MFCD00003350 InChI Key: SRWILAKSARHZPR-UHFFFAOYSA-N Synonym: m-chlorobenzaldehyde, benzaldehyde, 3-chloro, mcad, meta-chlorobenzaldehyde, benzaldehyde, m-chloro, 3-chloro benzaldehyde, 3-chloro-benzaldehyde, benzaldehyde, 3-chloro-9ci, ccris 8613, 3-chiorobenzaldehyde PubChem CID: 11477 IUPAC Name: 3-chlorobenzaldehyde SMILES: C1=CC(=CC(=C1)Cl)C=O

4-(1,3-Thiazol-2-yl)benzoic acid, 97%, Maybridge™

CAS: 266369-49-7 Molecular Formula: C10H7NO2S Molecular Weight (g/mol): 205.231 MDL Number: MFCD08275675 InChI Key: NCAPRAZCSUNRLM-UHFFFAOYSA-N Synonym: 4-1,3-thiazol-2-yl benzoic acid, 4-thiazol-2-yl benzoic acid, 4-2-thiazolyl benzoic acid, 4-thiazol-2-yl benzoicacid, benzoic acid,4-2-thiazolyl PubChem CID: 23510471 IUPAC Name: 4-(1,3-thiazol-2-yl)benzoic acid SMILES: C1=CC(=CC=C1C2=NC=CS2)C(=O)O

Alfa Aesar™ 2-Bromo-5-chlorobenzaldehyde, 97%

CAS: 174265-12-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 MDL Number: MFCD00462870 InChI Key: IIISHLMCTDMUHH-UHFFFAOYSA-N Synonym: 5-chloro-2-bromobenzaldehyde, benzaldehyde, 2-bromo-5-chloro, pubchem19849, acmc-1bwmm, ksc174i5n, 2-bromo-5-chlorobenzaldehycle, iiishlmctdmuhh-uhfffaoysa PubChem CID: 15391279 IUPAC Name: 2-bromo-5-chlorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)Br

4-Iodobenzaldehyde, 97+%, ACROS Organics™

CAS: 15164-44-0 Molecular Formula: C7H5IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039576 InChI Key: NIEBHDXUIJSHSL-UHFFFAOYSA-N Synonym: p-iodobenzaldehyde, benzaldehyde, 4-iodo, 4-iodo-benzaldehyde, iodobenzenecarbaldehyde, 4-iodo benzaldehyde, pubchem5349, acmc-1bpp9, intermediates-zcf02160, 4-iodobenzaldehyde, ksc181a1r PubChem CID: 96657 IUPAC Name: 4-iodobenzaldehyde SMILES: C1=CC(=CC=C1C=O)I

Alfa Aesar™ Phthalic acid, 99%

CAS: 88-99-3 Molecular Formula: C8H6O4 Molecular Weight (g/mol): 166.132 MDL Number: MFCD00002467 InChI Key: XNGIFLGASWRNHJ-UHFFFAOYSA-N Synonym: 1,2-benzenedicarboxylic acid, benzene-1,2-dicarboxylic acid, o-phthalic acid, o-dicarboxybenzene, o-benzenedicarboxylic acid, pathalic acid, acide phtalique, kyselina ftalova, ortho-phthalic acid, phthalicacid PubChem CID: 1017 ChEBI: CHEBI:29069 IUPAC Name: phthalic acid SMILES: C1=CC=C(C(=C1)C(=O)O)C(=O)O

Alfa Aesar™ 2,3,4-Trimethoxybenzaldehyde, 98+%

CAS: 2103-57-3 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003310 InChI Key: UCTUXUGXIFRVGX-UHFFFAOYSA-N Synonym: trimethoxybenzaldehyde, benzaldehyde, 2,3,4-trimethoxy, 2,3,4-trimethoxy-benzaldehyde, benzaldehyde, trimethoxy, 2,3,4 trimethoxybenzylaldehyde, pubchem8261, trimethoxy benzaldehyde, trimetazidine impurity c, acmc-1b07v, ksc201q5r PubChem CID: 75006 IUPAC Name: 2,3,4-trimethoxybenzaldehyde SMILES: COC1=C(C(=C(C=C1)C=O)OC)OC

Alfa Aesar™ p-Tolualdehyde, 98%

CAS: 104-87-0 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00006954 InChI Key: FXLOVSHXALFLKQ-UHFFFAOYSA-N Synonym: p-tolualdehyde, 4-tolualdehyde, p-formyltoluene, p-tolylaldehyde, p-toluylaldehyde, p-methylbenzaldehyde, para-tolualdehyde, benzaldehyde, 4-methyl, para-methylbenzaldehyde, para-toluyl aldehyde PubChem CID: 7725 ChEBI: CHEBI:28617 IUPAC Name: 4-methylbenzaldehyde SMILES: CC1=CC=C(C=C1)C=O

Alfa Aesar™ 4-n-Butylbenzoic acid, 99%

CAS: 20651-71-2 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00002571 InChI Key: JFKUBRAOUZEZSL-UHFFFAOYSA-N Synonym: 4-n-butylbenzoic acid, benzoic acid, 4-butyl, 4-butyl-benzoic acid, p-butylbenzoic acid, p-n-butylbenzoic acid, p-butyl benzoic acid, 4-butylbenzoicacid, p-n-butyl benzoic acid, acmc-209fcp, 4-n-butyl-benzoic acid PubChem CID: 88631 IUPAC Name: 4-butylbenzoic acid SMILES: CCCCC1=CC=C(C=C1)C(=O)O

Benzoyl isothiocyanate, 98%, ACROS Organics™

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.2 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide, benzoylisothiocyanate, benzoylisothiocyante, isothiocyanic acid benzoyl ester, unii-u8j7q32b86, n-benzoyl isothiocyanate, benzoic acid, anhydride with hncs, benzoic acid, anhydride with isothiocyanic acid, oxophenylmethanisothiocyanate, 1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

Alfa Aesar™ 4-Methylbenzoic anhydride, 97%

CAS: 13222-85-0 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048100 InChI Key: BJMLLSSSTGHJJE-UHFFFAOYSA-N Synonym: 4-methylbenzoic anhydride, 4-methylphenyl anhydride, 4-methylbenzoic acid anhydride, p-toluic anhydride, 4-methylbenzene-1-carboxylic anhydride, 4-methylbenzoyl 4-methylbenzoate, bis 4-methylbenzoic anhydride, p-toluylsaureanhydrid, para-toluic anhydride, 4-methylbenzoicanhydride PubChem CID: 139413 IUPAC Name: (4-methylbenzoyl) 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)C

Alfa Aesar™ n-Pentyl 4-aminobenzoate, 98%

CAS: 13110-37-7 Molecular Formula: C12H17NO2 Molecular Weight (g/mol): 207.273 MDL Number: MFCD00455845 InChI Key: VKYWCHMXHQTCJQ-UHFFFAOYSA-N Synonym: n-amyl 4-aminobenzoate, benzoic acid, 4-amino-, pentyl ester, n-pentyl 4-aminobenzoate, 4-aminobenzoic acid n-pentyl ester PubChem CID: 25706 IUPAC Name: pentyl 4-aminobenzoate SMILES: CCCCCOC(=O)C1=CC=C(C=C1)N

Alfa Aesar™ Biphenyl-2-carboxylic acid, 98%

CAS: 947-84-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00002463 InChI Key: ILYSAKHOYBPSPC-UHFFFAOYSA-N Synonym: 2-biphenylcarboxylic acid, 1,1'-biphenyl-2-carboxylic acid, o-phenylbenzoic acid, biphenyl-2-carboxylic acid, biphenylcarboxylic acid, 1,1'-biphenyl carboxylic acid, diphenyl-2-carboxylic acid, phenylbenzoic acid PubChem CID: 70357 IUPAC Name: 2-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

Alfa Aesar™ Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide, benzoylisothiocyanate, benzoylisothiocyante, isothiocyanic acid benzoyl ester, unii-u8j7q32b86, n-benzoyl isothiocyanate, benzoic acid, anhydride with hncs, benzoic acid, anhydride with isothiocyanic acid, oxophenylmethanisothiocyanate, 1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

Alfa Aesar™ 3-(Pentafluorothio)benzaldehyde, 97%

CAS: 401892-80-6 Molecular Formula: C7H5F5OS Molecular Weight (g/mol): 232.168 MDL Number: MFCD03788517 InChI Key: APFMXGBPENUHDD-UHFFFAOYSA-N Synonym: 3-pentafluorosulfanyl benzaldehyde, 3-pentafluorothio benzaldehyde, 3-pentafluoro-??-sulfanyl benzaldehyde, pubchem8517, 3-sulphurpentafluorobenzaldehyde, 3-pentafluorosulfur benzaldehyde, 3-formylphenyl pentafluorosulfur vi, 3-pentafluoro-$l^ 6-sulfanyl benzaldehyde, 3-pentakis fluoranyl-$l^ 6-sulfanyl benzaldehyde PubChem CID: 2779205 IUPAC Name: 3-(pentafluoro-$l^{6}-sulfanyl)benzaldehyde SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)C=O

Alfa Aesar™ 3-Fluoro-2-formylbenzeneboronic acid, 95%

CAS: 871126-15-7 Molecular Formula: C7H6BFO3 Molecular Weight (g/mol): 167.93 MDL Number: MFCD10697421 InChI Key: GVHWLCYABLWGIR-UHFFFAOYSA-N Synonym: 3-fluoro-2-formylphenyl boronic acid, 3-fluoro-2-formylbenzeneboronic acid, boronic acid, 3-fluoro-2-formylphenyl, acmc-209qf3, 2-formyl-3-fluorophenylboranic acid, 3-fluoro-2-formyl-phenyl boronic acid, 3-fluoro-2-formylphenylboronic acid, boronic acid, b-3-fluoro-2-formylphenyl, contains varying amounts of anhydride PubChem CID: 53412038 IUPAC Name: (3-fluoro-2-formylphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)F)C=O)(O)O

Alfa Aesar™ Benzoic acid, ACS, 99.5% min

CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00002398 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid, dracylic acid, benzeneformic acid, carboxybenzene, phenylformic acid, benzenemethanoic acid, phenylcarboxylic acid, retardex, benzoesaeure gk, benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O

Alfa Aesar™ Phthalamic acid, 99%

CAS: 88-97-1 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.148 MDL Number: MFCD00025476 InChI Key: CYMRPDYINXWJFU-UHFFFAOYSA-N Synonym: phthalamic acid, phthalamidic acid, phthalamide acid, phthalic monoamide, phthalic acid monoamide, o-carbamoylbenzoic acid, benzoic acid, 2-aminocarbonyl, benzoic acid, o-carbamoyl, unii-v344h4pf3y, 2-aminocarbonyl benzoic acid PubChem CID: 6957 ChEBI: CHEBI:50736 IUPAC Name: 2-carbamoylbenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)N)C(=O)O

4-Pyrimidin-2-ylbenzoic acid, 97%, Maybridge™

CAS: 199678-12-1 Molecular Formula: C11H8N2O2 Molecular Weight (g/mol): 200.197 MDL Number: MFCD01318668 InChI Key: WNDAEOTYLPWXPN-UHFFFAOYSA-N Synonym: 4-pyrimidin-2-yl-benzoic acid, 4-pyrimidin-2-yl benzoic acid, 4-2-pyrimidinyl benzoic acid, benzoic acid, 4-2-pyrimidinyl, benzoic acid, 4-2-pyrimidinyl-9ci, akos bar-2339, pubchem15861, acmc-1c8kl, 4-pyrimidin-2-yl-benzoicacid PubChem CID: 1514324 IUPAC Name: 4-pyrimidin-2-ylbenzoic acid SMILES: C1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)O

Alfa Aesar™ 4-n-Hexylbenzoic acid, 99%

CAS: 21643-38-9 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00013997 InChI Key: CPEPWESLFZVUEP-UHFFFAOYSA-N Synonym: benzoic acid, 4-hexyl, 4-n-hexylbenzoic acid, p-hexylbenzoic acid, benzoic acid, p-hexyl, p-n-hexylbenzoic acid, 4n-hexylbenzoic acid, maybridge1_002028, para-n-hexyl benzoic acid, acmc-1chu5, ksc201s3p PubChem CID: 30725 IUPAC Name: 4-hexylbenzoic acid SMILES: CCCCCCC1=CC=C(C=C1)C(=O)O

Alfa Aesar™ o-Toluic acid, 98+%

CAS: 118-90-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002477 InChI Key: ZWLPBLYKEWSWPD-UHFFFAOYSA-N Synonym: o-toluic acid, o-toluylic acid, orthotoluic acid, 2-toluic acid, toluic acid, benzoic acid, 2-methyl, o-methylbenzoic acid, 2-methyl-benzoic acid, benzoic acid, methyl, o-toluate PubChem CID: 8373 ChEBI: CHEBI:36632 IUPAC Name: 2-methylbenzoic acid SMILES: CC1=CC=CC=C1C(=O)O

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