(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone

C13H7BrClFO — CID 107996260

IUPAC(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7BrClFO/c14-11-7-8(15)5-6-9(11)13(17)10-3-1-2-4-12(10)16/h1-7H
InChIKeyJBOZMPXMIYGOBL-UHFFFAOYSA-N
MW313.55 g/mol
LogP4.47
Rot. Bonds2

About (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone

(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone (PubChem CID 107996260) has the molecular formula C13H7BrClFO and a molecular weight of 313.55 g/mol. Its IUPAC name is (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone.

Molecular Properties

Compound Name(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone
PubChem CID107996260
Molecular FormulaC13H7BrClFO
Molecular Weight313.55 g/mol
Exact Mass311.94
IUPAC Name(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1ccc(Cl)cc1Br
InChIInChI=1S/C13H7BrClFO/c14-11-7-8(15)5-6-9(11)13(17)10-3-1-2-4-12(10)16/h1-7H
InChIKeyJBOZMPXMIYGOBL-UHFFFAOYSA-N
XLogP4.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.55
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromo-4-chlorophenyl)-(4-bromo-2,5-difluorophenyl)methanone
CID 114024411
(4-bromo-2-chlorophenyl)-(2-fluorophenyl)methanone
CID 114965969
(4-bromo-5-chloro-2-fluorophenyl)-(2-bromo-4-chlorophenyl)methanone
CID 107987246
(2-bromo-4-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 114025571
(2-bromo-4-chlorophenyl)-(3,5-difluorophenyl)methanone
CID 107996333
(2-bromo-4-chlorophenyl)-(3-fluorophenyl)methanone
CID 107996213
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183
(2-bromophenyl)-(2,5-difluorophenyl)methanone
CID 43159861
(5-bromo-2-fluorophenyl)-(4-chloro-2-fluorophenyl)methanone
CID 79743347
(4-amino-2-bromophenyl)-(2-chloro-3-fluorophenyl)methanone
CID 81461861
(4-chloro-2-fluorophenyl)-(2-iodophenyl)methanone
CID 115791492
2-bromo-4-chloro-N-(2,6-difluorophenyl)benzamide
CID 113257211

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone?
The IUPAC name of (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone (CID 107996260) is (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone.
What is the SMILES notation for (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone?
The canonical SMILES for (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone is O=C(c1ccccc1F)c1ccc(Cl)cc1Br.
What is the InChIKey of (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone?
The InChIKey is JBOZMPXMIYGOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrClFO/c14-11-7-8(15)5-6-9(11)13(17)10-3-1-2-4-12(10)16/h1-7H.
What are the key properties of (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone?
(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone has a molecular weight of 313.55 g/mol, XLogP of 4.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone is sourced from PubChem (CID 107996260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).