1-(2-bromophenyl)-2-chloro-4-phenylbenzene

C18H12BrCl — CID 163289493

IUPAC1-(2-bromophenyl)-2-chloro-4-phenylbenzene
SMILESClc1cc(-c2ccccc2)ccc1-c1ccccc1Br
InChIInChI=1S/C18H12BrCl/c19-17-9-5-4-8-15(17)16-11-10-14(12-18(16)20)13-6-2-1-3-7-13/h1-12H
InChIKeyHFOMHIKWMILUDT-UHFFFAOYSA-N
MW343.65 g/mol
LogP6.44
Rot. Bonds2

About 1-(2-bromophenyl)-2-chloro-4-phenylbenzene

1-(2-bromophenyl)-2-chloro-4-phenylbenzene (PubChem CID 163289493) has the molecular formula C18H12BrCl and a molecular weight of 343.65 g/mol. Its IUPAC name is 1-(2-bromophenyl)-2-chloro-4-phenylbenzene.

Molecular Properties

Compound Name1-(2-bromophenyl)-2-chloro-4-phenylbenzene
PubChem CID163289493
Molecular FormulaC18H12BrCl
Molecular Weight343.65 g/mol
Exact Mass341.98
IUPAC Name1-(2-bromophenyl)-2-chloro-4-phenylbenzene
SMILESClc1cc(-c2ccccc2)ccc1-c1ccccc1Br
InChIInChI=1S/C18H12BrCl/c19-17-9-5-4-8-15(17)16-11-10-14(12-18(16)20)13-6-2-1-3-7-13/h1-12H
InChIKeyHFOMHIKWMILUDT-UHFFFAOYSA-N
XLogP6.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.65
LogP ≤ 56.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-(2-bromophenyl)-3-chloroaniline
CID 107615953
N-[4-[2-[2-(2-bromophenyl)phenyl]-5-phenylphenyl]phenyl]-N,4-diphenylaniline
CID 118049360
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
1-bromo-2-(4-chlorophenyl)-4-phenylbenzene
CID 166487719
2-bromo-1-chloro-4-(3-phenylphenyl)benzene
CID 178064983
2-(2-bromo-6-chlorophenyl)-6-phenylnaphthalene
CID 177097158
23-chloroundecacyclo[36.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29.230,33.234,37]hexaconta-1(40),2(60),3,5(59),6(58),7,9(57),10(56),11,13(55),14(54),15,17(53),18(52),19,21(51),22,24,26,28,30,32,34,36,38,41,43,45,47,49-triacontaene
CID 102127640
1-bromo-2-phenyl-4-(2-phenylphenyl)benzene
CID 170404819
1-(4-tert-butylphenyl)-2-chloro-4-phenylbenzene
CID 176866089
1,2,4-triphenylbenzene;1,3,5-triphenylbenzene
CID 162004033
4-bromo-2-chloro-1-phenylbenzene
CID 13457416

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-2-chloro-4-phenylbenzene?
The IUPAC name of 1-(2-bromophenyl)-2-chloro-4-phenylbenzene (CID 163289493) is 1-(2-bromophenyl)-2-chloro-4-phenylbenzene.
What is the SMILES notation for 1-(2-bromophenyl)-2-chloro-4-phenylbenzene?
The canonical SMILES for 1-(2-bromophenyl)-2-chloro-4-phenylbenzene is Clc1cc(-c2ccccc2)ccc1-c1ccccc1Br.
What is the InChIKey of 1-(2-bromophenyl)-2-chloro-4-phenylbenzene?
The InChIKey is HFOMHIKWMILUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12BrCl/c19-17-9-5-4-8-15(17)16-11-10-14(12-18(16)20)13-6-2-1-3-7-13/h1-12H.
What are the key properties of 1-(2-bromophenyl)-2-chloro-4-phenylbenzene?
1-(2-bromophenyl)-2-chloro-4-phenylbenzene has a molecular weight of 343.65 g/mol, XLogP of 6.44, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-2-chloro-4-phenylbenzene is sourced from PubChem (CID 163289493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).