(2-bromophenyl)-(2,5-difluorophenyl)methanone

C13H7BrF2O — CID 43159861

IUPAC(2-bromophenyl)-(2,5-difluorophenyl)methanone
SMILESO=C(c1cc(F)ccc1F)c1ccccc1Br
InChIInChI=1S/C13H7BrF2O/c14-11-4-2-1-3-9(11)13(17)10-7-8(15)5-6-12(10)16/h1-7H
InChIKeyYEZKPLQYIYJSOW-UHFFFAOYSA-N
MW297.10 g/mol
LogP3.96
Rot. Bonds2

About (2-bromophenyl)-(2,5-difluorophenyl)methanone

(2-bromophenyl)-(2,5-difluorophenyl)methanone (PubChem CID 43159861) has the molecular formula C13H7BrF2O and a molecular weight of 297.10 g/mol. Its IUPAC name is (2-bromophenyl)-(2,5-difluorophenyl)methanone.

Molecular Properties

Compound Name(2-bromophenyl)-(2,5-difluorophenyl)methanone
PubChem CID43159861
Molecular FormulaC13H7BrF2O
Molecular Weight297.10 g/mol
Exact Mass295.96
IUPAC Name(2-bromophenyl)-(2,5-difluorophenyl)methanone
SMILESO=C(c1cc(F)ccc1F)c1ccccc1Br
InChIInChI=1S/C13H7BrF2O/c14-11-4-2-1-3-9(11)13(17)10-7-8(15)5-6-12(10)16/h1-7H
InChIKeyYEZKPLQYIYJSOW-UHFFFAOYSA-N
XLogP3.96
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.10
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromophenyl)-(2-chloro-5-fluorophenyl)methanone
CID 105394203
(5-bromo-2-fluorophenyl)-(2,5-difluorophenyl)methanone
CID 43337432
(2-bromo-5-fluorophenyl)-(2-chlorophenyl)methanone
CID 114963342
(3-bromo-4-fluorophenyl)-(2-bromophenyl)methanone
CID 79736368
(2-bromo-4-fluorophenyl)-(2-fluoro-5-methylphenyl)methanone
CID 114970853
(2-bromo-4-chlorophenyl)-(2-fluorophenyl)methanone
CID 107996260
(2-bromo-5-fluorophenyl)-(2,3,4-trifluorophenyl)methanone
CID 114971661
(2-bromophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanone
CID 62866561
[2-(difluoromethoxy)phenyl]-(2,5-difluorophenyl)methanone
CID 43337454
(2-bromo-4-fluorophenyl)-(2,4-difluorophenyl)methanone
CID 43160008
(2,5-difluorophenyl)-(3-fluorophenyl)methanone
CID 43159843
(2-bromo-5-fluorophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanone
CID 62865668

Frequently Asked Questions

What is the IUPAC name of (2-bromophenyl)-(2,5-difluorophenyl)methanone?
The IUPAC name of (2-bromophenyl)-(2,5-difluorophenyl)methanone (CID 43159861) is (2-bromophenyl)-(2,5-difluorophenyl)methanone.
What is the SMILES notation for (2-bromophenyl)-(2,5-difluorophenyl)methanone?
The canonical SMILES for (2-bromophenyl)-(2,5-difluorophenyl)methanone is O=C(c1cc(F)ccc1F)c1ccccc1Br.
What is the InChIKey of (2-bromophenyl)-(2,5-difluorophenyl)methanone?
The InChIKey is YEZKPLQYIYJSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7BrF2O/c14-11-4-2-1-3-9(11)13(17)10-7-8(15)5-6-12(10)16/h1-7H.
What are the key properties of (2-bromophenyl)-(2,5-difluorophenyl)methanone?
(2-bromophenyl)-(2,5-difluorophenyl)methanone has a molecular weight of 297.10 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromophenyl)-(2,5-difluorophenyl)methanone is sourced from PubChem (CID 43159861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).