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Biphenyls and derivatives

Aromatic organic compounds that consist of two connected phenyl rings. Includes compounds derived from biphenyls.

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1

N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-2-oxoacetamide, TRC

Molecular Formula: C15H9Cl2NO3 Molecular Weight (g/mol): 322.14 IUPAC Name: N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-2-oxoacetamide SMILES: O=C(C([H])=O)NC(C=CC(Cl)=C1)=C1C(C2=C(Cl)C=CC=C2)=O

Molecular Weight (g/mol) 322.14
SMILES O=C(C([H])=O)NC(C=CC(Cl)=C1)=C1C(C2=C(Cl)C=CC=C2)=O
IUPAC Name N-(4-chloro-2-(2-chlorobenzoyl)phenyl)-2-oxoacetamide
Molecular Formula C15H9Cl2NO3
2

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

PubChem CID 629349
CAS 341-58-2
Molecular Weight (g/mol) 320.24
MDL Number MFCD00190155
SMILES NC1=CC(=C(C=C1)C1=C(C=C(N)C=C1)C(F)(F)F)C(F)(F)F
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
IUPAC Name 4-[4-amino-2-(trifluoromethyl)phenyl]-3-(trifluoromethyl)aniline
InChI Key NVKGJHAQGWCWDI-UHFFFAOYSA-N
Molecular Formula C14H10F6N2
3

4'-(Bromomethyl)biphenyl-2-carbonitrile, 98%

CAS: 114772-54-2 Molecular Formula: C14H10BrN Molecular Weight (g/mol): 272.145 MDL Number: MFCD00671503 InChI Key: LFFIEVAMVPCZNA-UHFFFAOYSA-N Synonym: 4'-bromomethyl-2-cyanobiphenyl,2-4-bromomethyl phenyl benzonitrile,2-cyano-4'-bromomethylbiphenyl,4'-bromomethyl-1,1'-biphenyl-2-carbonitrile,2-4-bromo-methylphenyl benzonitrile,4'-bromomethyl-2-biphenylcarbonitrile,4'-bromomethylbiphenyl-2-carbonitrile,2'-cyano-4-bromomethylbiphenyl,4-2-cyanophenyl benzyl bromide,unii-ui5jr3k10f PubChem CID: 1501912 IUPAC Name: 2-[4-(bromomethyl)phenyl]benzonitrile SMILES: C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CBr

PubChem CID 1501912
CAS 114772-54-2
Molecular Weight (g/mol) 272.145
MDL Number MFCD00671503
SMILES C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CBr
Synonym 4'-bromomethyl-2-cyanobiphenyl,2-4-bromomethyl phenyl benzonitrile,2-cyano-4'-bromomethylbiphenyl,4'-bromomethyl-1,1'-biphenyl-2-carbonitrile,2-4-bromo-methylphenyl benzonitrile,4'-bromomethyl-2-biphenylcarbonitrile,4'-bromomethylbiphenyl-2-carbonitrile,2'-cyano-4-bromomethylbiphenyl,4-2-cyanophenyl benzyl bromide,unii-ui5jr3k10f
IUPAC Name 2-[4-(bromomethyl)phenyl]benzonitrile
InChI Key LFFIEVAMVPCZNA-UHFFFAOYSA-N
Molecular Formula C14H10BrN
4

4-Bromo-2-methylbiphenyl, 98%

CAS: 5002-26-6 Molecular Formula: C13H11Br Molecular Weight (g/mol): 247.135 MDL Number: MFCD03093069 InChI Key: ZBNARPVMXYNXQQ-UHFFFAOYSA-N Synonym: 4-bromo-2-methylbiphenyl,4-bromo-2-methyl-1,1'-biphenyl,acmc-1asrj,2-methyl-4-bromobiphenyl,4-bromo-2-methyl-biphenyl,3-methyl-4-phenylbromobenzene,4-bromanyl-2-methyl-1-phenyl-benzene PubChem CID: 9964845 IUPAC Name: 4-bromo-2-methyl-1-phenylbenzene SMILES: CC1=C(C=CC(=C1)Br)C2=CC=CC=C2

PubChem CID 9964845
CAS 5002-26-6
Molecular Weight (g/mol) 247.135
MDL Number MFCD03093069
SMILES CC1=C(C=CC(=C1)Br)C2=CC=CC=C2
Synonym 4-bromo-2-methylbiphenyl,4-bromo-2-methyl-1,1'-biphenyl,acmc-1asrj,2-methyl-4-bromobiphenyl,4-bromo-2-methyl-biphenyl,3-methyl-4-phenylbromobenzene,4-bromanyl-2-methyl-1-phenyl-benzene
IUPAC Name 4-bromo-2-methyl-1-phenylbenzene
InChI Key ZBNARPVMXYNXQQ-UHFFFAOYSA-N
Molecular Formula C13H11Br
5

2-Methoxyphenylboronic acid, 97%

CAS: 5720-06-9 Molecular Formula: C7H9BO3 Molecular Weight (g/mol): 151.96 MDL Number: MFCD00236047 InChI Key: ROEQGIFOWRQYHD-UHFFFAOYSA-N SMILES: COC1=CC=CC=C1B(O)O

CAS 5720-06-9
Molecular Weight (g/mol) 151.96
MDL Number MFCD00236047
SMILES COC1=CC=CC=C1B(O)O
InChI Key ROEQGIFOWRQYHD-UHFFFAOYSA-N
Molecular Formula C7H9BO3
6

3-Bromo-4-fluoro-1,1'-biphenyl, 97%, Thermo Scientific™

CAS: 306935-88-6 Molecular Formula: C12H8BrF Molecular Weight (g/mol): 251.098 MDL Number: MFCD01571091 InChI Key: COWXPZSVUXHAFS-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorobiphenyl,3-bromo-4-fluoro-1,1'-biphenyl,acmc-20an8u,1,1'-biphenyl,3-bromo-4-fluoro,2-bromanyl-1-fluoranyl-4-phenyl-benzene PubChem CID: 2773367 IUPAC Name: 2-bromo-1-fluoro-4-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)F)Br

PubChem CID 2773367
CAS 306935-88-6
Molecular Weight (g/mol) 251.098
MDL Number MFCD01571091
SMILES C1=CC=C(C=C1)C2=CC(=C(C=C2)F)Br
Synonym 3-bromo-4-fluorobiphenyl,3-bromo-4-fluoro-1,1'-biphenyl,acmc-20an8u,1,1'-biphenyl,3-bromo-4-fluoro,2-bromanyl-1-fluoranyl-4-phenyl-benzene
IUPAC Name 2-bromo-1-fluoro-4-phenylbenzene
InChI Key COWXPZSVUXHAFS-UHFFFAOYSA-N
Molecular Formula C12H8BrF
7

4-[4-(4'-Chloro-2-biphenylylmethyl)-1-piperazinyl]benzoic acid, 97%

CAS: 916204-05-2 Molecular Formula: C24H23ClN2O2 Molecular Weight (g/mol): 406.91 MDL Number: MFCD16251290 InChI Key: FSHGEKXJPYDBSO-UHFFFAOYSA-N Synonym: 4-4-4'-chlorobiphenyl-2-ylmethyl piperazin-1-yl benzoic acid,4-4-4'-chloro-1,1'-biphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4'-chlorobiphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4'-chloro-2-biphenylylmethyl-1-piperazinyl benzoic acid,4-4-4'-chloro-1,1'-biphenyl-2-yl methyl-1-piperazinyl benzoic acid,4-4-4'-chloro 1,1'-biphenyl-2-yl methyl-1-piperazinyl benzoic acid,4-4-4'-chloro 1,1'-biphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4-chloro-1,1-biphenyl-2-yl methyl piperazin-1-yl benzoic acid PubChem CID: 53434985 IUPAC Name: 4-[4-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-yl]benzoic acid SMILES: OC(=O)C1=CC=C(C=C1)N1CCN(CC2=CC=CC=C2C2=CC=C(Cl)C=C2)CC1

PubChem CID 53434985
CAS 916204-05-2
Molecular Weight (g/mol) 406.91
MDL Number MFCD16251290
SMILES OC(=O)C1=CC=C(C=C1)N1CCN(CC2=CC=CC=C2C2=CC=C(Cl)C=C2)CC1
Synonym 4-4-4'-chlorobiphenyl-2-ylmethyl piperazin-1-yl benzoic acid,4-4-4'-chloro-1,1'-biphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4'-chlorobiphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4'-chloro-2-biphenylylmethyl-1-piperazinyl benzoic acid,4-4-4'-chloro-1,1'-biphenyl-2-yl methyl-1-piperazinyl benzoic acid,4-4-4'-chloro 1,1'-biphenyl-2-yl methyl-1-piperazinyl benzoic acid,4-4-4'-chloro 1,1'-biphenyl-2-yl methyl piperazin-1-yl benzoic acid,4-4-4-chloro-1,1-biphenyl-2-yl methyl piperazin-1-yl benzoic acid
IUPAC Name 4-[4-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-yl]benzoic acid
InChI Key FSHGEKXJPYDBSO-UHFFFAOYSA-N
Molecular Formula C24H23ClN2O2
8

trans-4-[4-(4-n-Pentylcyclohexyl)phenyl]benzonitrile, 99%, Thermo Scientific™

CAS: 68065-81-6 Molecular Formula: C24H29N Molecular Weight (g/mol): 331.503 MDL Number: MFCD01076317 InChI Key: QKEBUASRTJNJJS-UHFFFAOYSA-N Synonym: 4'-trans-4-pentylcyclohexyl-1,1'-biphenyl-4-carbonitrile,trans-4'-4-pentylcyclohexyl-4-biphenylcarbonitrile,trans-4-4-pentylcyclohexyl-4'-cyanobiphenyl,4-trans-4-n-pentylcyclohexyl biphenyl-4'-carbonitrile,4-4-4-pentylcyclohexyl phenyl benzonitrile,1,1'-biphenyl-4-carbonitrile, 4'-trans-4-pentylcyclohexyl,4-cyano-4'-trans-4-pentylcyclohexyl biphenyl,4'-trans-4-amylcyclohexyl biphenyl-4-carbonitrile,trans-4'-4-pentylcyclohexyl 1,1'-biphenyl-4-carbonitrile PubChem CID: 106491 IUPAC Name: 4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile SMILES: CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

PubChem CID 106491
CAS 68065-81-6
Molecular Weight (g/mol) 331.503
MDL Number MFCD01076317
SMILES CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N
Synonym 4'-trans-4-pentylcyclohexyl-1,1'-biphenyl-4-carbonitrile,trans-4'-4-pentylcyclohexyl-4-biphenylcarbonitrile,trans-4-4-pentylcyclohexyl-4'-cyanobiphenyl,4-trans-4-n-pentylcyclohexyl biphenyl-4'-carbonitrile,4-4-4-pentylcyclohexyl phenyl benzonitrile,1,1'-biphenyl-4-carbonitrile, 4'-trans-4-pentylcyclohexyl,4-cyano-4'-trans-4-pentylcyclohexyl biphenyl,4'-trans-4-amylcyclohexyl biphenyl-4-carbonitrile,trans-4'-4-pentylcyclohexyl 1,1'-biphenyl-4-carbonitrile
IUPAC Name 4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile
InChI Key QKEBUASRTJNJJS-UHFFFAOYSA-N
Molecular Formula C24H29N
9

3-Bromo-4-methoxybiphenyl, 99%, Thermo Scientific™

CAS: 74447-73-7 Molecular Formula: C13H11BrO Molecular Weight (g/mol): 263.13 MDL Number: MFCD00079720 InChI Key: QJGJVVIDRMVQMR-UHFFFAOYSA-N Synonym: 3-bromo-4-methoxybiphenyl,3-bromo-4-methoxy-1,1'-biphenyl,2-bromo-1-methoxy-4-phenyl-menzene,acmc-20an8p,2-bromo-4-phenylanisole,maybridge3_000975,3-bromo-4-methoxy-biphenyl,2-methoxy-5-phenyl-phenylbromide,2-bromo-1-methoxy-4-phenyl-benzene PubChem CID: 262267 IUPAC Name: 2-bromo-1-methoxy-4-phenylbenzene SMILES: COC1=CC=C(C=C1Br)C1=CC=CC=C1

PubChem CID 262267
CAS 74447-73-7
Molecular Weight (g/mol) 263.13
MDL Number MFCD00079720
SMILES COC1=CC=C(C=C1Br)C1=CC=CC=C1
Synonym 3-bromo-4-methoxybiphenyl,3-bromo-4-methoxy-1,1'-biphenyl,2-bromo-1-methoxy-4-phenyl-menzene,acmc-20an8p,2-bromo-4-phenylanisole,maybridge3_000975,3-bromo-4-methoxy-biphenyl,2-methoxy-5-phenyl-phenylbromide,2-bromo-1-methoxy-4-phenyl-benzene
IUPAC Name 2-bromo-1-methoxy-4-phenylbenzene
InChI Key QJGJVVIDRMVQMR-UHFFFAOYSA-N
Molecular Formula C13H11BrO
10

4'-Cyano-4-biphenylyl trans-4-n-propylcyclohexanecarboxylate, 99%, Thermo Scientific™

CAS: 67284-57-5 Molecular Formula: C23H25NO2 Molecular Weight (g/mol): 347.458 MDL Number: MFCD01076321 InChI Key: YVEDSNAPDAXLDD-UHFFFAOYSA-N Synonym: 4'-cyanobiphenyl-4-yl trans-4-propylcyclohexanecarboxylate,4-4-cyanophenyl phenyl 4-propylcyclohexane-1-carboxylate,trans-4-propyl-cyclohexanecarboxylic acid 4'-cyano-biphenyl-4-yl ester,4'-cyano-4-biphenylyl trans-4-n-propylcyclohexanecarboxylate,4-propylcyclohexanecarboxylic acid 4'-cyanobiphenyl-4-yl ester,4'-cyano 1,1'-biphenyl-4-yl 4-propylcyclohexane-1-carboxylate,trans-4'-cyano-1,1'-biphenyl-4-yl 4-propylcyclohexanecarboxylate,4-propyl-1-cyclohexanecarboxylic acid 4-4-cyanophenyl phenyl ester PubChem CID: 15044673 IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-propylcyclohexane-1-carboxylate SMILES: CCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

PubChem CID 15044673
CAS 67284-57-5
Molecular Weight (g/mol) 347.458
MDL Number MFCD01076321
SMILES CCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N
Synonym 4'-cyanobiphenyl-4-yl trans-4-propylcyclohexanecarboxylate,4-4-cyanophenyl phenyl 4-propylcyclohexane-1-carboxylate,trans-4-propyl-cyclohexanecarboxylic acid 4'-cyano-biphenyl-4-yl ester,4'-cyano-4-biphenylyl trans-4-n-propylcyclohexanecarboxylate,4-propylcyclohexanecarboxylic acid 4'-cyanobiphenyl-4-yl ester,4'-cyano 1,1'-biphenyl-4-yl 4-propylcyclohexane-1-carboxylate,trans-4'-cyano-1,1'-biphenyl-4-yl 4-propylcyclohexanecarboxylate,4-propyl-1-cyclohexanecarboxylic acid 4-4-cyanophenyl phenyl ester
IUPAC Name [4-(4-cyanophenyl)phenyl] 4-propylcyclohexane-1-carboxylate
InChI Key YVEDSNAPDAXLDD-UHFFFAOYSA-N
Molecular Formula C23H25NO2
11

3-Bromo-4-fluorobiphenyl, 98%

CAS: 306935-88-6 Molecular Formula: C12H8BrF Molecular Weight (g/mol): 251.098 MDL Number: MFCD01571091 InChI Key: COWXPZSVUXHAFS-UHFFFAOYSA-N Synonym: 3-bromo-4-fluorobiphenyl,3-bromo-4-fluoro-1,1'-biphenyl,acmc-20an8u,1,1'-biphenyl,3-bromo-4-fluoro,2-bromanyl-1-fluoranyl-4-phenyl-benzene PubChem CID: 2773367 IUPAC Name: 2-bromo-1-fluoro-4-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)F)Br

PubChem CID 2773367
CAS 306935-88-6
Molecular Weight (g/mol) 251.098
MDL Number MFCD01571091
SMILES C1=CC=C(C=C1)C2=CC(=C(C=C2)F)Br
Synonym 3-bromo-4-fluorobiphenyl,3-bromo-4-fluoro-1,1'-biphenyl,acmc-20an8u,1,1'-biphenyl,3-bromo-4-fluoro,2-bromanyl-1-fluoranyl-4-phenyl-benzene
IUPAC Name 2-bromo-1-fluoro-4-phenylbenzene
InChI Key COWXPZSVUXHAFS-UHFFFAOYSA-N
Molecular Formula C12H8BrF
12

4-(4'-Chloro-4-biphenylylsulfonylamino)benzoic acid, 96%, Thermo Scientific™

CAS: 885269-32-9 Molecular Formula: C19H14ClNO4S Molecular Weight (g/mol): 387.834 MDL Number: MFCD06409447 InChI Key: AYWSYJTWHIPSFL-UHFFFAOYSA-N Synonym: 4-4'-chloro-4-biphenylylsulfonylamino benzoic acid,4-4'-chloro-1,1'-biphenyl-4-sulfonamido benzoic acid,4-4'-chloro-1,1'-biphenyl-4-ylsulfonamido benzoic acid PubChem CID: 44669160 IUPAC Name: 4-[[4-(4-chlorophenyl)phenyl]sulfonylamino]benzoic acid SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)Cl)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O

PubChem CID 44669160
CAS 885269-32-9
Molecular Weight (g/mol) 387.834
MDL Number MFCD06409447
SMILES C1=CC(=CC=C1C2=CC=C(C=C2)Cl)S(=O)(=O)NC3=CC=C(C=C3)C(=O)O
Synonym 4-4'-chloro-4-biphenylylsulfonylamino benzoic acid,4-4'-chloro-1,1'-biphenyl-4-sulfonamido benzoic acid,4-4'-chloro-1,1'-biphenyl-4-ylsulfonamido benzoic acid
IUPAC Name 4-[[4-(4-chlorophenyl)phenyl]sulfonylamino]benzoic acid
InChI Key AYWSYJTWHIPSFL-UHFFFAOYSA-N
Molecular Formula C19H14ClNO4S