CAS: 603-45-2 Molecular Formula: C19H14O3 Molecular Weight (g/mol): 290.32 MDL Number: MFCD00001624 InChI Key: FYEHYMARPSSOBO-UHFFFAOYSA-N Synonym: 4-bis 4-hydroxyphenyl methylene cyclohexa-2,5-dienone, aurin no. 555, 4,4'-dihydroxyfuchsone, corallin spirit soluble, spirit aurine, aurine, p-rosolic acid, corallin, rosolic acid, aurin PubChem CID: 5100 ChEBI: CHEBI:34544 IUPAC Name: 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one SMILES: OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)=C1C=CC(=O)C=C1

Induces severe colitis (inflammatory bowel disease) in laboratory animals

CAS: 17814-85-6 Molecular Formula: C23H24BrO2P Molecular Weight (g/mol): 443.32 MDL Number: MFCD00011906 InChI Key: MLOSJPZSZWUDSK-UHFFFAOYSA-N Synonym: 4-carboxybutyl triphenyl phosphonium bromide, triphenyl 4-carboxybutyl phosphonium bromide, 4-carboxybutyl-triphenylphosphonium bromide, 5-triphenylphosphonio pentanoic acid bromide, carboxybutyltriphenylphosphonium bromide, 4-carboxybutyl triphenylphosphanium bromide, phosphonium, 4-carboxybutyl triphenyl-, bromide, 4-carboxybutyl triphenylphosphonium bromide PubChem CID: 161236 IUPAC Name: 4-carboxybutyl(triphenyl)phosphanium;bromide SMILES: [Br-].OC(=O)CCCC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

Crystal Violet, C25H30ClN3, CAS Number-548-62-9, 90-94-8, Basic Violet 3, C.I. 42555, Gentian Violet, 100g, 13, 756, CHEBI:41688, 407.99, Pure, Danger, GHS H Statement: Very toxic to aquatic life with long lasting effects. Harmful if swallowed. Causes serious eye damage. May cause cancer.

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonic acid hydrate, 3bto78gaff, p-toluenesulfonic acid, monohydrate, ptoluenesulfonic acid, benzenesulfonic acid, 4-methyl-, monohydrate, unii-3bto78gaff, p-toluene sulfonic acid monohydrate, 4-methylbenzenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, p-toluenesulfonic acid monohydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

CAS: 6192-52-5 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonic acid hydrate, 3bto78gaff, p-toluenesulfonic acid, monohydrate, ptoluenesulfonic acid, benzenesulfonic acid, 4-methyl-, monohydrate, unii-3bto78gaff, p-toluene sulfonic acid monohydrate, 4-methylbenzenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, p-toluenesulfonic acid monohydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

CAS: 95-53-4 Molecular Formula: C₇H₉N Molecular Weight (g/mol): 107.15 MDL Number: MFCD00007730 InChI Key: RNVCVTLRINQCPJ-UHFFFAOYSA-N Synonym: o-methylbenzenamine, o-aminotoluene, benzenamine, 2-methyl, o-methylaniline, ortho-toluidine, 2-methylbenzenamine, 2-aminotoluene, o-tolylamine, 2-toluidine, o-toluidine PubChem CID: 7242 ChEBI: CHEBI:66892 IUPAC Name: 2-methylaniline SMILES: CC1=CC=CC=C1N

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: 4-methylbenzene-1-sulfonic acid hydrate, 3bto78gaff, p-toluenesulfonic acid, monohydrate, ptoluenesulfonic acid, benzenesulfonic acid, 4-methyl-, monohydrate, unii-3bto78gaff, p-toluene sulfonic acid monohydrate, 4-methylbenzenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, p-toluenesulfonic acid monohydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

CAS: 1667-99-8 Molecular Formula: C23H13Cl2Na3O9S Molecular Weight (g/mol): 605.277 MDL Number: MFCD00001615 InChI Key: FUIZKNBTOOKONL-UHFFFAOYSA-K Synonym: C.I. 43825, Mordant Blue 29 PubChem CID: 54736314 IUPAC Name: trisodium;5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichloro-3-sulfonatophenyl)methyl]-3-methyl-2-oxidobenzoate SMILES: CC1=CC(=CC(=C1[O-])C(=O)[O-])C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]

CAS: 1746-23-2 Molecular Formula: C12H16 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00065126 InChI Key: QEDJMOONZLUIMC-UHFFFAOYSA-N Synonym: 4-t-butyl styrene, 1-tert-butyl-4-vinylbenzene, 9pct9cbw0v, 1-1,1-dimethylethyl-4-ethenylbenzene, unii-9pct9cbw0v, styrene, p-tert-butyl, benzene, 1-1,1-dimethylethyl-4-ethenyl, p-t-butylstyrene, p-tert-butylstyrene, 4-tert-butylstyrene PubChem CID: 15627 IUPAC Name: 1-tert-butyl-4-ethenylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C=C

CAS: 103-65-1 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.20 MDL Number: MFCD00009377 InChI Key: ODLMAHJVESYWTB-UHFFFAOYSA-N Synonym: propylbenzene, n, unii-0wr86zhg2z, propyl-benzene, n-propyl benzene, isocumene, 1-propylbenzene, benzene, propyl, phenylpropane, 1-phenylpropane, n-propylbenzene PubChem CID: 7668 ChEBI: CHEBI:42630 IUPAC Name: propylbenzene SMILES: CCCC1=CC=CC=C1

CAS: 1877-75-4 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00014360 InChI Key: BHFSBJHPPFJCOS-UHFFFAOYSA-N Synonym: rarechem al bo 0321, akos bb/0049, p-methoxyphenoxy acetic acid, acetic acid, 2-4-methoxyphenoxy, acetic acid, p-methoxyphenoxy, p-methoxyphenoxyacetic acid, acetic acid, 4-methoxyphenoxy, 4-methoxyphenoxy acetic acid, 2-4-methoxyphenoxy acetic acid, 4-methoxyphenoxyacetic acid PubChem CID: 74649 IUPAC Name: 2-(4-methoxyphenoxy)acetic acid SMILES: COC1=CC=C(OCC(O)=O)C=C1

CAS: 462-06-6 Molecular Formula: C6H5F Molecular Weight (g/mol): 96.10 MDL Number: MFCD00000280 InChI Key: PYLWMHQQBFSUBP-UHFFFAOYSA-N Synonym: 1,2,3,4,5-pentadeuterio-6-fluorobenzene, fluorobenzenes, fluoranylbenzene, unii-g3tsz68k12, 4-fluorobenzene, fluoro-benzene, fluorbenzol, phenyl fluoride, monofluorobenzene, benzene, fluoro PubChem CID: 10008 ChEBI: CHEBI:5115 IUPAC Name: fluorobenzene SMILES: FC1=CC=CC=C1

CAS: 119-61-9 Molecular Formula: C₁₃H₁₀O Molecular Weight (g/mol): 182.22 InChI Key: RWCCWEUUXYIKHB-UHFFFAOYSA-N Synonym: diphenylketone, alpha-oxodiphenylmethane, benzene, benzoyl, ketone, diphenyl, alpha-oxoditane, methanone, diphenyl, phenyl ketone, benzoylbenzene, diphenyl ketone, benzophenone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC Name: diphenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

CAS: 403-33-8 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00017959 InChI Key: MSEBQGULDWDIRW-UHFFFAOYSA-N Synonym: asischem p32019, acmc-1aef0, pubchem3566, 4-fluoro-benzoic acid methyl ester, methyl-4-fluorobenzoate, methyl4-fluorobenzoate, benzoic acid, 4-fluoro-, methyl ester, methyl 4-fluorobenzoic acid, 4-fluorobenzoic acid methyl ester, methyl p-fluorobenzoate PubChem CID: 67878 IUPAC Name: methyl 4-fluorobenzoate SMILES: COC(=O)C1=CC=C(C=C1)F

CAS: 13826-35-2 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00004636 InChI Key: KGANAERDZBAECK-UHFFFAOYSA-N Synonym: 3-pboh, benzyl alcohol, m-phenoxy, 3-phenoxybenzylic alcohol, 3-hydroxymethyl diphenyl ether, benzenemethanol, 3-phenoxy, 3-phenoxybenzenemethanol, m-phenoxybenzyl alcohol, 3-phenoxybenzylalcohol, 3-phenoxyphenyl methanol, 3-phenoxybenzyl alcohol PubChem CID: 26295 ChEBI: CHEBI:62527 IUPAC Name: (3-phenoxyphenyl)methanol SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)CO

CAS: 552-89-6 Molecular Formula: C7H5NO3 Molecular Weight (g/mol): 151.121 MDL Number: MFCD00007132 InChI Key: CMWKITSNTDAEDT-UHFFFAOYSA-N Synonym: ortho-nitrobenzaldehyde, benzaldehyde, nitro, unii-48b18q9b8e, ccris 2322, 2-formylnitrobenzene, 2-nitro-benzaldehyde, benzaldehyde, o-nitro, nitrobenzaldehyde, benzaldehyde, 2-nitro, o-nitrobenzaldehyde PubChem CID: 11101 ChEBI: CHEBI:66927 IUPAC Name: 2-nitrobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)[N+](=O)[O-]

CAS: 23165-29-9 Molecular Formula: C9H3F6NS Molecular Weight (g/mol): 271.18 MDL Number: MFCD00040838 InChI Key: FXOSSGVJGGNASE-UHFFFAOYSA-N Synonym: acmc-209g1w, pubchem5019, benzene, 1-isothiocyanato-3,5-bis trifluoromethyl, 3,5-bis-trifluoromethylphenyl isothiocyanate, 3,5-bis-trifluoromethyl phenyl isothiocyanate, 3,5-di trifluoromethyl phenyl isothiocyanate, isothiocyanic acid 3,5-bis trifluoromethyl phenyl ester, 3,5-bis trifluoromethyl phenylisothiocyanate, 1-isothiocyanato-3,5-bis trifluoromethyl benzene, 3,5-bis trifluoromethyl phenyl isothiocyanate PubChem CID: 2733395 IUPAC Name: 1-isothiocyanato-3,5-bis(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC(=CC(=C1)N=C=S)C(F)(F)F

CAS: 55289-36-6 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.052 MDL Number: MFCD00051579 InChI Key: IILVSKMKMOJHMA-UHFFFAOYSA-N Synonym: 3-brom-2-methylanilin, 3-bromo-2-methyl-benzenamine, 3-bromo-2-methylphenylamine, 3-bromo-2-methyl-aniline, 3-bromo-2-methyl-phenylamine, 2-bromo-6-aminotoluene, 3-bromo-2-methylbenzenamine, benzenamine, 3-bromo-2-methyl, 3-bromo-o-toluidine, 2-amino-6-bromotoluene PubChem CID: 123538 IUPAC Name: 3-bromo-2-methylaniline SMILES: CC1=C(C=CC=C1Br)N

CAS: 445-29-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002405 InChI Key: NSTREUWFTAOOKS-UHFFFAOYSA-N Synonym: 2-fluoro-benzoic acid, ofba, o-fluorbenzoesaeure german, unii-64uz32koo4, fluorobenzoic acid, benzoic acid, o-fluoro, o-fluorbenzoesaeure, ortho-fluorobenzoic acid, benzoic acid, 2-fluoro, o-fluorobenzoic acid PubChem CID: 9935 ChEBI: CHEBI:19577 IUPAC Name: 2-fluorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)F

CAS: 9003-53-6 Molecular Formula: (C8H8)n Molecular Weight (g/mol): 104.15 MDL Number: MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N Synonym: styrolene, phenethylene, monomer, phenylethene, cinnamene, benzene, ethenyl, styrol, vinylbenzene, phenylethylene, ethenylbenzene PubChem CID: 7501 ChEBI: CHEBI:27452 SMILES: *-CC(-*)C1=CC=CC=C1

CAS: 21524-39-0 Molecular Formula: C7H3F2N Molecular Weight (g/mol): 139.105 MDL Number: MFCD00009976 InChI Key: GKPHNZYMLJPYJJ-UHFFFAOYSA-N Synonym: ksc493a8b, 2.3-difluoro benzonitrile, 2,3-difluoro-benzonitrile, 2,3-difluorobenzonitril, acmc-209flg, pubchem1564, difluorobenzonitrile, ncr bf cf, 2,3-difluorobenzenecarbonitrile, benzonitrile, 2,3-difluoro PubChem CID: 88935 IUPAC Name: 2,3-difluorobenzonitrile SMILES: C1=CC(=C(C(=C1)F)F)C#N

CAS: 367-29-3 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007764 InChI Key: JLCDTNNLXUMYFQ-UHFFFAOYSA-N Synonym: 5-fluor-2-methylanilin, 5-fluoro-2-methylphenylamine, 5-fluoro-2-methyl-aniline, 5-fluoro-2-methyl-phenylamine, benzenamine, 5-fluoro-2-methyl, 2-methyl-5-fluoroaniline, 3-fluoro-6-methylaniline, 5-fluoro-o-toluidine, 2-amino-4-fluorotoluene PubChem CID: 67774 IUPAC Name: 5-fluoro-2-methylaniline SMILES: CC1=CC=C(F)C=C1N

CAS: 3096-81-9 Molecular Formula: C13H9NO Molecular Weight (g/mol): 195.221 MDL Number: MFCD00017346 InChI Key: UYHCIOZMFCLUDP-UHFFFAOYSA-N Synonym: ksc497e6d, 4-phenoxybenzonitrile, acmc-209hjp, 4-cyanodiphenyl ether, 4-phenoxybenzenecarbonitrile, benzonitrile, 4-phenoxy PubChem CID: 137821 IUPAC Name: 4-phenoxybenzonitrile SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)C#N

CAS: 24470-78-8 Molecular Formula: C21H22IP Molecular Weight (g/mol): 432.29 MDL Number: MFCD00031595 InChI Key: HHBXWXJLQYJJBW-UHFFFAOYSA-M Synonym: isopropyltriphenylphosphine iodide, ksc493k7j, acmc-209gck, isopropyl triphenylphosphonium iodide, i-propyl triphenylphosphonium iodide, triphenyl propan-2-yl phosphanium iodide, isopropyl triphenyl phosphonium iodide, isopropyltriphenylphosphanium iodide, phosphonium, 1-methylethyl triphenyl-, iodide, isopropyltriphenylphosphonium iodide PubChem CID: 2723783 IUPAC Name: triphenyl(propan-2-yl)phosphanium;iodide SMILES: [I-].CC(C)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

CAS: 3288-04-8 MDL Number: MFCD00011675

CAS: 53055-05-3 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007135 InChI Key: GDTUACILWWLIJF-UHFFFAOYSA-N PubChem CID: 98867 IUPAC Name: 3-methoxy-2-nitrobenzaldehyde SMILES: COC1=CC=CC(C=O)=C1[N+]([O-])=O

CAS: 14264-16-5 Molecular Formula: C36H30Cl2NiP2 Molecular Weight (g/mol): 654.18 MDL Number: MFCD00009592 MFCD00003043 MFCD20489348 InChI Key: VHQPRJDILRYZBG-UHFFFAOYSA-L Synonym: bis triphenylphosphine dichloronickel ii PubChem CID: 131664342 IUPAC Name: nickel(2+);triphenylphosphane;dihydrochloride SMILES: Cl[Ni++]Cl.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

CAS: 2096-86-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00017250 InChI Key: NOXKUHSBIXPZBJ-UHFFFAOYSA-N Synonym: acmc-20amd6, p-methylphenylacetone, 2-propanone,1-4-methylphenyl, 1-4-methylphenyl-2-propanone, p-methylphenyl acetone, 1-4-methylphenyl acetone, 4-methylphenyl acetone, 1-p-tolyl propan-2-one, 1-4-methylphenyl propan-2-one, 4-methylphenylacetone PubChem CID: 137428 IUPAC Name: 1-(4-methylphenyl)propan-2-one SMILES: CC1=CC=C(C=C1)CC(=O)C

CAS: 1449133-22-5 Molecular Formula: C12H10BFN2O3 Molecular Weight (g/mol): 260.031 MDL Number: MFCD20265181 InChI Key: CIQKUPRZPUUGGK-UHFFFAOYSA-N Synonym: 3-fluoro-4-2-pyridylcarbamoyl phenylboronic acid, 3-fluoro-4-pyridin-2-yl carbamoyl phenylboronic acid, 3-fluoro-4-2-pyridylcarbamoyl benzeneboronic acid PubChem CID: 73995642 IUPAC Name: [3-fluoro-4-(pyridin-2-ylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)NC2=CC=CC=N2)F)(O)O