1-bromo-2-[chloro(diphenyl)methyl]benzene

C19H14BrCl — CID 15938887

IUPAC1-bromo-2-[chloro(diphenyl)methyl]benzene
SMILESClC(c1ccccc1)(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C19H14BrCl/c20-18-14-8-7-13-17(18)19(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKeyFOAFRRBRTHRVBN-UHFFFAOYSA-N
MW357.68 g/mol
LogP5.98
Rot. Bonds3

About 1-bromo-2-[chloro(diphenyl)methyl]benzene

1-bromo-2-[chloro(diphenyl)methyl]benzene (PubChem CID 15938887) has the molecular formula C19H14BrCl and a molecular weight of 357.68 g/mol. Its IUPAC name is 1-bromo-2-[chloro(diphenyl)methyl]benzene.

Molecular Properties

Compound Name1-bromo-2-[chloro(diphenyl)methyl]benzene
PubChem CID15938887
Molecular FormulaC19H14BrCl
Molecular Weight357.68 g/mol
Exact Mass356.00
IUPAC Name1-bromo-2-[chloro(diphenyl)methyl]benzene
SMILESClC(c1ccccc1)(c1ccccc1)c1ccccc1Br
InChIInChI=1S/C19H14BrCl/c20-18-14-8-7-13-17(18)19(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKeyFOAFRRBRTHRVBN-UHFFFAOYSA-N
XLogP5.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.68
LogP ≤ 55.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-[chloro(diphenyl)methyl]benzene?
The IUPAC name of 1-bromo-2-[chloro(diphenyl)methyl]benzene (CID 15938887) is 1-bromo-2-[chloro(diphenyl)methyl]benzene.
What is the SMILES notation for 1-bromo-2-[chloro(diphenyl)methyl]benzene?
The canonical SMILES for 1-bromo-2-[chloro(diphenyl)methyl]benzene is ClC(c1ccccc1)(c1ccccc1)c1ccccc1Br.
What is the InChIKey of 1-bromo-2-[chloro(diphenyl)methyl]benzene?
The InChIKey is FOAFRRBRTHRVBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrCl/c20-18-14-8-7-13-17(18)19(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H.
What are the key properties of 1-bromo-2-[chloro(diphenyl)methyl]benzene?
1-bromo-2-[chloro(diphenyl)methyl]benzene has a molecular weight of 357.68 g/mol, XLogP of 5.98, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-[chloro(diphenyl)methyl]benzene is sourced from PubChem (CID 15938887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).