Benzenoids
3-Bromo-9,9-diphenyl-9H-fluorene 98.0+%, TCI America™
CAS: 1547491-70-2 Molecular Formula: C25H17Br Molecular Weight (g/mol): 397.315 MDL Number: MFCD24849694 InChI Key: AXVLLFWWMWDULG-UHFFFAOYSA-N PubChem CID: 90026835 IUPAC Name: 3-bromo-9,9-diphenylfluorene SMILES: C1=CC=C(C=C1)C2(C3=C(C=C(C=C3)Br)C4=CC=CC=C42)C5=CC=CC=C5
5-Fluoro-o-cresol 98.0+%, TCI America™
CAS: 452-85-7 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00673009 InChI Key: CKJOSIHYVLHIER-UHFFFAOYSA-N Synonym: 4-fluoro-2-hydroxytoluene,5-fluoro-o-cresol,5-fluoro-2-methyl-phenol,pubchem1502,2-methyl-5-fluorophenol,acmc-1afs5,5-fluoranyl-2-methyl-phenol,ksc494a2f PubChem CID: 2774616 IUPAC Name: 5-fluoro-2-methylphenol SMILES: CC1=C(C=C(C=C1)F)O
3-Hydroxy-2-methylbenzoic Acid 98.0+%, TCI America™
CAS: 603-80-5 Molecular Formula: C8H7O3 Molecular Weight (g/mol): 151.14 MDL Number: MFCD00671541 InChI Key: RIERSGULWXEJKL-UHFFFAOYSA-M Synonym: 3-hydroxy-o-toluic acid,3-hydroxy-2-methyl benzoic acid,3-hydroxy-2-methyl-benzoic acid,2-methyl-3-hydroxybenzoic acid,benzoic acid, 3-hydroxy-2-methyl,kresolsaure,3,2-cresotic acid,pubchem15694,3-carboxy-2-methylphenol,acmc-1b1jy PubChem CID: 252023 IUPAC Name: 3-hydroxy-2-methylbenzoate SMILES: CC1=C(O)C=CC=C1C([O-])=O
5-(2-Hydroxyethyl)amino-o-cresol 98.0+%, TCI America™
CAS: 55302-96-0 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD01707346 InChI Key: YGRFRBUGAPOJDU-UHFFFAOYSA-N Synonym: 5-(2-Hydroxyethyl)amino-2-methylphenol PubChem CID: 134396 IUPAC Name: 5-(2-hydroxyethylamino)-2-methylphenol SMILES: CC1=C(C=C(C=C1)NCCO)O
4-Nitro-m-cresol 98.0+%, TCI America™
CAS: 2581-34-2 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007333 InChI Key: PIIZYNQECPTVEO-UHFFFAOYSA-N Synonym: 4-nitro-m-cresol,4-nitro-3-cresol,4-nitro-3-methylphenol,2-nitro-5-hydroxytoluene,5-hydroxy-2-nitrotoluene,phenol, 3-methyl-4-nitro,4-nitro-5-methylphenol,m-cresol, 4-nitro,p-nitro-m-cresol,4-nitro-1-hydroxy-3-methylbenzene PubChem CID: 17412 ChEBI: CHEBI:38683 IUPAC Name: 3-methyl-4-nitrophenol SMILES: CC1=CC(O)=CC=C1[N+]([O-])=O
2,3,5,6-Tetrabromo-p-cresol 97.0+%, TCI America™
CAS: 37721-75-8 Molecular Formula: C7H4Br4O Molecular Weight (g/mol): 423.72 MDL Number: MFCD00060318 InChI Key: OMVMKSWFUQZIFD-UHFFFAOYSA-N PubChem CID: 458139 IUPAC Name: 2,3,5,6-tetrabromo-4-methylphenol SMILES: CC1=C(Br)C(Br)=C(O)C(Br)=C1Br
2-Ethyl-6-methylphenol 98.0+%, TCI America™
CAS: 1687-64-5 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00962292 InChI Key: CIRRFAQIWQFQSS-UHFFFAOYSA-N Synonym: phenol, 2-ethyl-6-methyl,o-cresol, 6-ethyl,6-ethyl-o-cresol,unii-359wuc62ri,2-ethyl-6-methyl-phenol,6-ethyl-2-methylphenol,acmc-20anwj,2-methyl-6-ethylphenol,2-ethyl-6-methyl phenol,phenol,2-ethyl-6-methyl PubChem CID: 519333 IUPAC Name: 2-ethyl-6-methylphenol SMILES: CCC1=CC=CC(=C1O)C
3-Nitro-p-cresol 98.0+%, TCI America™
CAS: 2042-14-0 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 MDL Number: MFCD00007244 InChI Key: BQEXDUKMTVYBRK-UHFFFAOYSA-N Synonym: 3-nitro-4-methylphenol,3-nitro-p-cresol,4-methyl-3-nitro-phenol,4-hydroxy-2-nitrotoluene,2-nitro-4-hydroxytoluene,phenol, 4-methyl-3-nitro,p-cresol, 3-nitro,unii-4b422hud6h,4-methyl-5-nitrophenol PubChem CID: 16271 IUPAC Name: 4-methyl-3-nitrophenol SMILES: CC1=C(C=C(C=C1)O)[N+](=O)[O-]
6-Bromo-o-cresol 94.0+%, TCI America™
CAS: 13319-71-6 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD09907876 InChI Key: YXZPTVOCJLCMRO-UHFFFAOYSA-N Synonym: 2-Bromo-6-methylphenol PubChem CID: 11095329 IUPAC Name: 2-bromo-6-methylphenol SMILES: CC1=C(O)C(Br)=CC=C1
2,3-Dimethylphenol 98.0+%, TCI America™
CAS: 526-75-0 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00002227 InChI Key: QWBBPBRQALCEIZ-UHFFFAOYSA-N Synonym: 1-hydroxy-2,3-dimethylbenzene,2,3-xylenol,dimethylphenol,xylenol,phenol, 2,3-dimethyl,o-xylenol,vic-o-xylenol,o-3-xylenol,xyellenol 100,2,3-dimethyl phenol PubChem CID: 10687 IUPAC Name: 2,3-dimethylphenol SMILES: CC1=C(C(=CC=C1)O)C
2,6-Dimethylphenol 99.0+%, TCI America™
CAS: 576-26-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00002240 InChI Key: NXXYKOUNUYWIHA-UHFFFAOYSA-N Synonym: 2,6-xylenol,phenol, 2,6-dimethyl,2,6-dimethyl phenol,2-hydroxy-m-xylene,1-hydroxy-2,6-dimethylbenzene,vic-m-xylenol,2,6-dmp,2,6-dimethyl-phenol,xylenol 235,2-hydroxy-1,3-dimethylbenzene PubChem CID: 11335 IUPAC Name: 2,6-dimethylphenol SMILES: CC1=CC=CC(C)=C1O
Phenethyl Caffeate 98.0+%, TCI America™
CAS: 104594-70-9 Molecular Formula: C17H16O4 Molecular Weight (g/mol): 284.31 MDL Number: MFCD00866470 InChI Key: SWUARLUWKZWEBQ-VQHVLOKHSA-N Synonym: caffeic acid phenethyl ester,phenethyl caffeate,cape,capeee,phenethyl 3-3,4-dihydroxyphenyl acrylate,phenylethyl caffeate,unii-g960r9s5sk,caffeic acid phenylethyl ester,2-phenylethyl caffeate,caffeic acid 2-phenylethyl ester PubChem CID: 5281787 ChEBI: CHEBI:8062 IUPAC Name: 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: OC1=CC=C(\C=C\C(=O)OCCC2=CC=CC=C2)C=C1O
4-Allylpyrocatechol 98.0+%, TCI America™
CAS: 1126-61-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD01548379 InChI Key: FHEHIXJLCWUPCZ-UHFFFAOYSA-N Synonym: 4-Allyl-1,2-benzenediol, 4-Allyl-1,2-dihydroxybenzene, 4-Allylcatechol, Hydroxychavicol PubChem CID: 70775 IUPAC Name: 4-prop-2-enylbenzene-1,2-diol SMILES: C=CCC1=CC(=C(C=C1)O)O
Methyl Caffeate 98.0+%, TCI America™
CAS: 3843-74-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00210468 InChI Key: OCNYGKNIVPVPPX-HWKANZROSA-N Synonym: methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 PubChem CID: 689075 ChEBI: CHEBI:6856 IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC(=C(C=C1)O)O