1-bromo-2-phenyl-4-(2-phenylphenyl)benzene

C24H17Br — CID 170404819

IUPAC1-bromo-2-phenyl-4-(2-phenylphenyl)benzene
SMILESBrc1ccc(-c2ccccc2-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C24H17Br/c25-24-16-15-20(17-23(24)19-11-5-2-6-12-19)22-14-8-7-13-21(22)18-9-3-1-4-10-18/h1-17H
InChIKeyICDMQKADBSYXJS-UHFFFAOYSA-N
MW385.30 g/mol
LogP7.45
Rot. Bonds3

About 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene

1-bromo-2-phenyl-4-(2-phenylphenyl)benzene (PubChem CID 170404819) has the molecular formula C24H17Br and a molecular weight of 385.30 g/mol. Its IUPAC name is 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene.

Molecular Properties

Compound Name1-bromo-2-phenyl-4-(2-phenylphenyl)benzene
PubChem CID170404819
Molecular FormulaC24H17Br
Molecular Weight385.30 g/mol
Exact Mass384.05
IUPAC Name1-bromo-2-phenyl-4-(2-phenylphenyl)benzene
SMILESBrc1ccc(-c2ccccc2-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C24H17Br/c25-24-16-15-20(17-23(24)19-11-5-2-6-12-19)22-14-8-7-13-21(22)18-9-3-1-4-10-18/h1-17H
InChIKeyICDMQKADBSYXJS-UHFFFAOYSA-N
XLogP7.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.30
LogP ≤ 57.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-bromo-2-(4-chlorophenyl)-4-phenylbenzene
CID 166487719
1-bromo-4-(4-methylphenyl)-2-phenylbenzene
CID 70958469
2-(4-phenylphenyl)bicyclo[2.2.0]hexa-1,3,5-triene
CID 174878589
1-bromo-4-[4-bromo-2,5-bis(4-phenylphenyl)phenyl]-2,5-bis(4-phenylphenyl)benzene
CID 175787735
2-(5-bromo-2-methylphenyl)-1-methyl-4-(2-phenylphenyl)benzene
CID 154595887
tricyclo[6.6.0.02,6]tetradeca-1,3,5,7,9,11,13-heptaene
CID 101119071
1,2-di(azulen-1-yl)azulene
CID 91306184
1-bromo-4-(4-bromo-3-phenylphenyl)sulfonyl-2-phenylbenzene
CID 59266839
1-bromo-4-(4-cyclohexylphenyl)-2-phenylbenzene
CID 150910002
11-phenylnonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1(32),2(48),3,5(47),6(46),7,9(45),10,12,14(42),15,17(41),18,20,22,24,26,28,30,33,35,37,39,43-tetracosaene
CID 135036112
1,2,4-triphenylbenzene
CID 518325
2-phenyl-1-(2-phenylazulen-1-yl)azulene
CID 177444827

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene?
The IUPAC name of 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene (CID 170404819) is 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene.
What is the SMILES notation for 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene?
The canonical SMILES for 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene is Brc1ccc(-c2ccccc2-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene?
The InChIKey is ICDMQKADBSYXJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17Br/c25-24-16-15-20(17-23(24)19-11-5-2-6-12-19)22-14-8-7-13-21(22)18-9-3-1-4-10-18/h1-17H.
What are the key properties of 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene?
1-bromo-2-phenyl-4-(2-phenylphenyl)benzene has a molecular weight of 385.30 g/mol, XLogP of 7.45, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-phenyl-4-(2-phenylphenyl)benzene is sourced from PubChem (CID 170404819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).