Benzenoids
Dicinnamalacetone 98.0+%, TCI America™
CAS: 622-21-9 Molecular Formula: C21H18O Molecular Weight (g/mol): 286.374 MDL Number: MFCD00004792 InChI Key: RLJALOQFYHCJKG-XCBHXTLASA-N Synonym: acetone, dicinnamylidene,1z,3e,6e,8e-1,9-diphenylnona-1,3,6,8-tetraen-5-one,1,9-diphenylnona-1,3,6,8-tetraen-5-one,1,3,6,8-nonatetraen-5-one, 1,9-diphenyl,1,6,8-nonatetraen-5-one, 1,9-diphenyl,1z,3e,6e,8e-1,9-diphenyl-5-nona-1,3,6,8-tetraenone PubChem CID: 6436875 IUPAC Name: (1Z,3E,6E,8E)-1,9-diphenylnona-1,3,6,8-tetraen-5-one SMILES: C1=CC=C(C=C1)C=CC=CC(=O)C=CC=CC2=CC=CC=C2
4-Hydroxy-4'-methoxybiphenyl 95.0+%, TCI America™
CAS: 16881-71-3 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00191514 InChI Key: CORJIEYQXMZUIW-UHFFFAOYSA-N PubChem CID: 11030839 IUPAC Name: 4-(4-methoxyphenyl)phenol SMILES: COC1=CC=C(C=C1)C2=CC=C(C=C2)O
(3-Bromophenyl)thiourea 98.0+%, TCI America™
CAS: 21327-14-0 Molecular Formula: C7H7BrN2S Molecular Weight (g/mol): 231.111 MDL Number: MFCD00060440 InChI Key: XBRVSIPVHYWULW-UHFFFAOYSA-N PubChem CID: 2735619 IUPAC Name: (3-bromophenyl)thiourea SMILES: C1=CC(=CC(=C1)Br)NC(=S)N
4-Methoxy-2-(trifluoromethyl)benzaldehyde 97.0+%, TCI America™
CAS: 106312-36-1 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD01091011 InChI Key: BVPVUMRIGHMFNV-UHFFFAOYSA-N Synonym: 4-methoxy-2-trifluoromethyl benzaldehyde,benzaldehyde, 4-methoxy-2-trifluoromethyl,4-formyl-3-trifluoromethyl anisole,pubchem1463,acmc-1c5gx,ksc504i7t,2-formyl-5-methoxybenzotrifluoride,4-methoxy-2-trifluoromethyl-benzaldehyde,benzaldehyde,4-methoxy-2-trifluoromethyl PubChem CID: 2778286 IUPAC Name: 4-methoxy-2-(trifluoromethyl)benzaldehyde SMILES: COC1=CC(=C(C=C1)C=O)C(F)(F)F
Diphenylphosphoryl Azide 97.0+%, TCI America™
CAS: 26386-88-9 Molecular Formula: C12H10N3O3P Molecular Weight (g/mol): 275.20 MDL Number: MFCD00001987 InChI Key: SORGEQQSQGNZFI-UHFFFAOYSA-N Synonym: diphenylphosphoryl azide,diphenyl azidophosphate,diphenylphosphonic azide,diphenyl phosphoryl azide,diphenyl phosphorazidate,phosphorazidic acid, diphenyl ester,azido phenoxy phosphoryl oxy benzene,dppa polymer-bound,diphenylphosphorazidate,unii-gxm91165av PubChem CID: 123414 IUPAC Name: {[azido(phenoxy)phosphoryl]oxy}benzene SMILES: [N-]=[N+]=NP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1
2-Bromo-N-(tert-butoxycarbonyl)benzylamine 98.0+%, TCI America™
CAS: 162356-90-3 Molecular Formula: C12H16BrNO2 Molecular Weight (g/mol): 286.169 MDL Number: MFCD05664385 InChI Key: DFNZFCPEUDSNEO-UHFFFAOYSA-N Synonym: tert-butyl 2-bromobenzylcarbamate,n-boc-2-bromobenzylamine,n-tert-butoxycarbonyl-2-bromobenzylamine,tert-butyl n-2-bromophenyl methyl carbamate,2-bromo-benzyl-carbamic acid tert-butyl ester,tert-butyl 2-bromobenzyl carbamate,2-bromobenzyl carbamic acid tert-butyl ester,1-tert-butoxycarbonylaminomethyl-2-bromobenzene,carbamic acid, 2-bromophenyl methyl-, 1,1-dimethylethyl ester,pubchem7804 PubChem CID: 7018300 IUPAC Name: tert-butyl N-[(2-bromophenyl)methyl]carbamate SMILES: CC(C)(C)OC(=O)NCC1=CC=CC=C1Br
Methyl 3-Methyl-2-nitrobenzoate 98.0+%, TCI America™
CAS: 5471-82-9 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD01003947 InChI Key: NJHDBIXFFZVJGZ-UHFFFAOYSA-N Synonym: methyl3-methyl-2-nitrobenzoate,methyl 3-methyl-2-nitrobenzenecarboxylate,benzoic acid, 3-methyl-2-nitro-, methyl ester,2-nitro-3-methylbenzoic acid, methyl ester,3-methyl-2-nitrobenzoic acid methyl ester,pubchem10932,acmc-1ap0b,ksc495q9t,methyl 2-nitro-3-methylbenzoate,methyl 3-methyl-2-nitro-benzoate PubChem CID: 79621 IUPAC Name: methyl 3-methyl-2-nitrobenzoate SMILES: CC1=CC=CC(=C1[N+](=O)[O-])C(=O)OC
3-(Trifluoromethyl)phenyl Isothiocyanate 98.0+%, TCI America™
CAS: 1840-19-3 Molecular Formula: C8H4F3NS Molecular Weight (g/mol): 203.182 MDL Number: MFCD00004806 InChI Key: GFEPANUKFYVALF-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-3-trifluoromethyl benzene,3-trifluoromethyl phenylisothiocyanate,benzene, 1-isothiocyanato-3-trifluoromethyl,m-trifluoromethyl phenyl isothiocyanate,alpha,alpha,alpha-trifluoro-m-tolyl isothiocyanate,3-trifluoromethylphenyl isothiocyanate,1-isothiocyanato-3-trifluoromethyl-benzene,benzene,1-isothiocyanato-3-trifluoromethyl PubChem CID: 137232 IUPAC Name: 1-isothiocyanato-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)N=C=S)C(F)(F)F
Methyl 3-Methoxy-2-naphthoate 98.0+%, TCI America™
CAS: 13041-60-6 Molecular Formula: C13H12O3 Molecular Weight (g/mol): 216.236 MDL Number: MFCD00454253 InChI Key: MPLSAOVNAXJHHI-UHFFFAOYSA-N Synonym: 3-Methoxy-2-naphthoic Acid Methyl Ester PubChem CID: 296952 IUPAC Name: methyl 3-methoxynaphthalene-2-carboxylate SMILES: COC1=CC2=CC=CC=C2C=C1C(=O)OC
2-Amino-4-(trifluoromethyl)benzonitrile 98.0+%, TCI America™
CAS: 1483-54-1 Molecular Formula: C8H5F3N2 Molecular Weight (g/mol): 186.137 MDL Number: MFCD04974124 InChI Key: IAIRNHIXDCZUCV-UHFFFAOYSA-N Synonym: 3-Amino-4-cyanobenzotrifluoride, 2-Cyano-5-(trifluoromethyl)aniline, 4-(Trifluoromethyl)anthranilonitrile PubChem CID: 13439028 IUPAC Name: 2-amino-4-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1C(F)(F)F)N)C#N
2-Amino-4-chlorodiphenyl Ether 98.0+%, TCI America™
CAS: 93-67-4 Molecular Formula: C12H10ClNO Molecular Weight (g/mol): 219.668 MDL Number: MFCD00025217 InChI Key: SXEBHIMOUHBBOS-UHFFFAOYSA-N Synonym: 2-amino-4-chlorophenyl phenyl ether,benzenamine, 5-chloro-2-phenoxy,4-chlor-2-aminodiphenylether,2-amino-4-chlorodiphenyl ether,5-chloro-2-phenoxy-aniline,unii-66sm796mdb,5-chloro-2-phenoxybenzenamine,5-chloro-2-phenoxyphenylamine,2-amino-4-chlorodiphenylether,4-chloro-2-aminodiphenyl ether PubChem CID: 66738 IUPAC Name: 5-chloro-2-phenoxyaniline SMILES: C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N
Hexyl Benzoate 98.0+%, TCI America™
CAS: 6789-88-4 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00051714 InChI Key: UUGLJVMIFJNVFH-UHFFFAOYSA-N Synonym: benzoic acid, hexyl ester,benzoic acid n-hexyl ester,n-hexylbenzoate,n-hexyl benzoate,1-hexyl benzoate,hexylbenzoate,hexylester kyseliny benzoove,benzoic acid hexyl ester,unii-vr3c36ekjr,fema no. 3691 PubChem CID: 23235 IUPAC Name: hexyl benzoate SMILES: CCCCCCOC(=O)C1=CC=CC=C1
2-Bromo-5-chloroanisole 98.0+%, TCI America™
CAS: 174913-09-8 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.478 MDL Number: MFCD03790889 InChI Key: CQGYLDZGJLVLMK-UHFFFAOYSA-N Synonym: 2-bromo-5-chloroanisole,benzene, 1-bromo-4-chloro-2-methoxy,pubchem5265,acmc-1c20c,ksc497i0p,2-bromo-5-chloroanisole, 98+%,2-methoxy-4-chloro-1-bromobenzene,1-bromo-4-chloro-2-methoxy-benzene PubChem CID: 17984845 IUPAC Name: 1-bromo-4-chloro-2-methoxybenzene SMILES: COC1=C(C=CC(=C1)Cl)Br
3-Hydroxy-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 602-00-6 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00017003 InChI Key: KPDBKQKRDJPBRM-UHFFFAOYSA-N Synonym: 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid PubChem CID: 293291 SMILES: C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O
1,3-Dibenzyloxybenzene 96.0+%, TCI America™
CAS: 3769-42-4 Molecular Formula: C20H18O2 Molecular Weight (g/mol): 290.36 MDL Number: MFCD00690156 InChI Key: RESHZVQZWMQUMB-UHFFFAOYSA-N Synonym: 1,3-Bis(benzyloxy)benzene, Resorcinol Dibenzyl Ether PubChem CID: 1363616 IUPAC Name: 1,3-bis(benzyloxy)benzene SMILES: C(OC1=CC(OCC2=CC=CC=C2)=CC=C1)C1=CC=CC=C1