Benzenoids
3-Fluorotoluene, 98%
CAS: 352-70-5 Molecular Formula: C7H7F Molecular Weight (g/mol): 110.13 MDL Number: MFCD00000339 InChI Key: BTQZKHUEUDPRST-UHFFFAOYSA-N Synonym: 3-fluorotoluene,m-fluorotoluene,benzene, 1-fluoro-3-methyl,1-fluoro-3-methyl-benzene,1-methyl-3-fluorobenzene,toluene, m-fluoro,unii-f72w445dq0,3-fluorobenzyl radical,meta-fluorotoluene,acmc-209ifn PubChem CID: 9606 IUPAC Name: 1-fluoro-3-methylbenzene SMILES: CC1=CC=CC(F)=C1
3-Fluorophenyl isocyanate, 97+%
CAS: 404-71-7 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.11 MDL Number: MFCD00002015 InChI Key: RIKWVZGZRYDACA-UHFFFAOYSA-N Synonym: 3-fluorophenyl isocyanate,m-fluorophenyl isocyanate,3-fluorophenylisocyanate,m-fluorophenylisocyanate,benzene, 1-fluoro-3-isocyanato,3-isocyanatofluorobenzene,isocyanic acid 3-fluorophenyl ester,3-fluorobenzenisocyanate,pubchem4995,acmc-1ajez PubChem CID: 123064 IUPAC Name: 1-fluoro-3-isocyanatobenzene SMILES: FC1=CC=CC(=C1)N=C=O
Methyl 2-chloro-4-fluorophenylacetate, 98%
CAS: 214262-88-1 Molecular Formula: C9H8ClFO2 Molecular Weight (g/mol): 202.61 MDL Number: MFCD00800611 InChI Key: DFTYYBRLWCAUHP-UHFFFAOYSA-N Synonym: methyl 2-2-chloro-4-fluorophenyl acetate,methyl 2-chloro-4-fluorophenylacetate,benzeneacetic acid, 2-chloro-4-fluoro-, methyl ester,methyl-2-chloro-4-fluorophenylacetate,pubchem16488,methyl 2-chloro-4-fluorophenyl acetate,methyl2-2-chloro-4-fluorophenyl acetate,2-chloro-4-fluorophenyl-acetic acid methyl ester,2-chloro-4-fluorophenyl acetic acid methyl ester,methyl 2-chloro-4-fluorophenylacetate 98 PubChem CID: 736123 IUPAC Name: methyl 2-(2-chloro-4-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=C(F)C=C1Cl
2-(2-Fluorophenyl)ethanol, 99%
CAS: 50919-06-7 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.16 MDL Number: MFCD00002887 InChI Key: HNIGZVZDWCTFPR-UHFFFAOYSA-N Synonym: 2-fluorophenethyl alcohol,2-2-fluorophenyl ethanol,2-2-fluorophenyl ethan-1-ol,benzeneethanol, 2-fluoro,2-fluorophenethylalcohol,2-2-fluoro-phenyl-ethanol,2-fluorobenzeneethanol,acmc-1axdv,o-fluorophenethyl alcohol,2-fluorophenylethyl alcohol PubChem CID: 2733296 IUPAC Name: 2-(2-fluorophenyl)ethanol SMILES: OCCC1=CC=CC=C1F
6-Bromo-2,3-difluorotoluene, 95%
CAS: 847502-81-2 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.018 MDL Number: MFCD07777161 InChI Key: YXTCBTSPHSNDHD-UHFFFAOYSA-N PubChem CID: 12137677 IUPAC Name: 1-bromo-3,4-difluoro-2-methylbenzene SMILES: CC1=C(C=CC(=C1F)F)Br
4-Bromo-3-fluorotoluene, 98%
CAS: 452-74-4 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00040940 InChI Key: SLFNGVGRINFJLK-UHFFFAOYSA-N Synonym: 4-bromo-3-fluorotoluene,3-fluoro-4-bromotoluene,benzene, 1-bromo-2-fluoro-4-methyl,3-fluoro-4-bromo-toluene,4-bromo-3-fluoro-1-methylbenzene,1-bromo-2-fluoro-4-methyl-benzene,3-fluoro-4-bromo-toluone,1-brom-2-fluor-4-methylbenzol,zlchem 562 PubChem CID: 573280 IUPAC Name: 1-bromo-2-fluoro-4-methylbenzene SMILES: CC1=CC(=C(C=C1)Br)F
4-Chloro-1,2-difluorobenzene, 98%
CAS: 696-02-6 Molecular Formula: C6H3ClF2 Molecular Weight (g/mol): 148.537 MDL Number: MFCD00042572 InChI Key: OPQMRQYYRSTBME-UHFFFAOYSA-N Synonym: 1-chloro-3,4-difluorobenzene,3,4-difluorochlorobenzene,4-chloro-1,2-difluoro-benzene,benzene, 4-chloro-1,2-difluoro,pubchem3417,3,4-diflurochlorobenzene,acmc-209o9n,ksc493g2d,3,4-difluoro-1-chlorobenzene PubChem CID: 136519 IUPAC Name: 4-chloro-1,2-difluorobenzene SMILES: C1=CC(=C(C=C1Cl)F)F
2,4-Difluoromandelic acid, 97%
CAS: 132741-30-1 Molecular Formula: C8H6F2O3 Molecular Weight (g/mol): 188.13 MDL Number: MFCD00061296 InChI Key: RRRQFGNNRJHLNV-UHFFFAOYSA-N Synonym: 2,4-difluoromandelic acid,2-2,4-difluorophenyl-2-hydroxyacetic acid,2,4-difluorophenyl hydroxy acetic acid,2,4-difluoro mandelic acid,2,4-difluoro-a-hydroxyphenylacetic acid,alpha-hydroxy-2,4-difluorophenylacetic acid,2,4-difluorophenyl hydroxy acetic acid #,2,4-difluoro-alpha-hydroxybenzeneacetic acid,currency-hydroxy-2,4-difluorophenylacetic acid PubChem CID: 588651 IUPAC Name: 2-(2,4-difluorophenyl)-2-hydroxyacetic acid SMILES: C1=CC(=C(C=C1F)F)C(C(=O)O)O
1-Chloro-4-fluorobenzene, 98%
CAS: 352-33-0 Molecular Formula: C6H4ClF Molecular Weight (g/mol): 130.55 MDL Number: MFCD00000603 InChI Key: RJCGZNCCVKIBHO-UHFFFAOYSA-N Synonym: p-chlorofluorobenzene,p-fluorochlorobenzene,4-chlorofluorobenzene,benzene, 1-chloro-4-fluoro,1-fluoro-4-chlorobenzene,1-chloro-4-fluoro-benzene,4-fluorochlorobenzene,1,4-fluorochlorobenzene,p-chloro-fluorobenzene,pubchem3420 PubChem CID: 9604 IUPAC Name: 1-chloro-4-fluorobenzene SMILES: FC1=CC=C(Cl)C=C1
2,2'-Bis(trifluoromethyl)benzidine, 97%
CAS: 341-58-2 Molecular Formula: C14H10F6N2 Molecular Weight (g/mol): 320.24 MDL Number: MFCD00190155 InChI Key: NVKGJHAQGWCWDI-UHFFFAOYSA-N Synonym: 2,2'-bis trifluoromethyl benzidine,2,2'-bis trifluoromethyl-1,1'-biphenyl-4,4'-diamine,4-4-amino-2-trifluoromethyl phenyl-3-trifluoromethyl aniline,2,2'-bis trifluoromethyl-4,4'-diaminobiphenyl,2,2'-bis-trifluoromethyl-biphenyl-4,4'-diamine,tfmb,2,2'-bis trifluoromethyl-4,4'-biphenyldiamine,4,4'-diamino-2,2'-bis trifluoromethyl biphenyl,1,1'-biphenyl-4,4'-diamine, 2,2'-bis trifluoromethyl,4-4-azanyl-2-trifluoromethyl phenyl-3-trifluoromethyl aniline PubChem CID: 629349 IUPAC Name: 4-[4-amino-2-(trifluoromethyl)phenyl]-3-(trifluoromethyl)aniline SMILES: NC1=CC(=C(C=C1)C1=C(C=C(N)C=C1)C(F)(F)F)C(F)(F)F
4-Bromobiphenyl, 98+%
CAS: 92-66-0 Molecular Formula: C12H9Br Molecular Weight (g/mol): 233.108 MDL Number: MFCD00000100 InChI Key: PKJBWOWQJHHAHG-UHFFFAOYSA-N Synonym: 4-bromobiphenyl,p-bromobiphenyl,4-bromo-1,1'-biphenyl,4-bromodiphenyl,1,1'-biphenyl, 4-bromo,4-biphenyl bromide,p-bromodiphenyl,biphenyl, 4-bromo,4-bromo-biphenyl,p-phenylbromobenzene PubChem CID: 7101 IUPAC Name: 1-bromo-4-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)Br
4'-Hydroxybiphenyl-4-carbonitrile, 99%, Thermo Scientific Chemicals
CAS: 19812-93-2 Molecular Formula: C13H9NO Molecular Weight (g/mol): 195.221 MDL Number: MFCD00059625 InChI Key: ZRMIETZFPZGBEB-UHFFFAOYSA-N Synonym: 4-cyano-4'-hydroxybiphenyl,4'-hydroxy-4-biphenylcarbonitrile,4-4-hydroxyphenyl benzonitrile,4'-hydroxybiphenyl-4-carbonitrile,4'-cyano-4-hydroxybiphenyl,4'-hydroxy-1,1'-biphenyl-4-carbonitrile,4'-cyano-4-biphenylol,4-cyano-4'-hydroxy-biphenyl,4'-hydroxy-4-cyanobiphenyl,4-hydroxy-4-biphenylcarbonitrile PubChem CID: 140610 IUPAC Name: 4-(4-hydroxyphenyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C2=CC=C(C=C2)O
3,5-Dihydroxytoluene monohydrate, 97%
CAS: 6153-39-5 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00149092 InChI Key: NBKPNAMTHBIMLA-UHFFFAOYSA-N Synonym: 5-methylbenzene-1,3-diol hydrate,orcinol monohydrate,5-methylresorcinol monohydrate,3,5-dihydroxytoluene monohydrate,orcinol hydrate,resorcinol, 5-methyl-, monohydrate,1,3-benzenediol, 5-methyl-, monohydrate,1,3-dihydroxy-5-methylbenzene monohydrate,acmc-209mtl,5-methylresorcinol hydrate PubChem CID: 3083941 IUPAC Name: 5-methylbenzene-1,3-diol;hydrate SMILES: CC1=CC(=CC(=C1)O)O.O
2-Allyl-4,6-dibenzoylresorcinol, 98%
CAS: 102593-74-8 Molecular Formula: C23H18O4 Molecular Weight (g/mol): 358.393 MDL Number: MFCD02094038 InChI Key: FSYGSBMXRNPJAD-UHFFFAOYSA-N Synonym: 2-allyl-4,6-dibenzoylresorcinol,5-allyl-4,6-dihydroxy-1,3-phenylene bis phenylmethanone,methanone, 4,6-dihydroxy-5-2-propenyl-1,3-phenylene bis phenyl,4,6-dibenzoyl-2-prop-2-en-1-yl benzene-1,3-diol,2allyl-4,6-dibenzoylresorcinol,methanone, 1,1'-4,6-dihydroxy-5-2-propen-1-yl-1,3-phenylene bis 1-phenyl,pubchem21315,acmc-20ao5t PubChem CID: 7010346 IUPAC Name: (5-benzoyl-2,4-dihydroxy-3-prop-2-enylphenyl)-phenylmethanone SMILES: C=CCC1=C(C(=CC(=C1O)C(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)O
2,3-Dimethylhydroquinone, 97%
CAS: 608-43-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00009997 InChI Key: BXJGUBZTZWCMEX-UHFFFAOYSA-N Synonym: 2,3-dimethylhydroquinone,o-xylene-3,6-diol,2,3-xylohydroquinone,o-xylohydroquinone,1,4-benzenediol, 2,3-dimethyl,unii-f0l7hg609j,1,4-dihydroxy-2,3-dimethylbenzene,3,6-dihydroxy-o-xylene,2,3-dimethyl-1,4-benzenediol,2,3-dimethyl hydroquinone PubChem CID: 69100 IUPAC Name: 2,3-dimethylbenzene-1,4-diol SMILES: CC1=C(C)C(O)=CC=C1O