(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone

C15H12BrFO — CID 43337277

IUPAC(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2ccc(F)cc2Br)c1
InChIInChI=1S/C15H12BrFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3
InChIKeyDGUHLMYVDSKANA-UHFFFAOYSA-N
MW307.16 g/mol
LogP4.44
Rot. Bonds2

About (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone

(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone (PubChem CID 43337277) has the molecular formula C15H12BrFO and a molecular weight of 307.16 g/mol. Its IUPAC name is (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone.

Molecular Properties

Compound Name(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
PubChem CID43337277
Molecular FormulaC15H12BrFO
Molecular Weight307.16 g/mol
Exact Mass306.01
IUPAC Name(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
SMILESCc1ccc(C)c(C(=O)c2ccc(F)cc2Br)c1
InChIInChI=1S/C15H12BrFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3
InChIKeyDGUHLMYVDSKANA-UHFFFAOYSA-N
XLogP4.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.16
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-bromo-4-fluorophenyl)-(2-fluoro-5-methylphenyl)methanone
CID 114970853
(2-chloro-4-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43159718
(2-bromo-4-methylphenyl)-(2,4-difluorophenyl)methanone;ethane
CID 142346677
(2,5-difluorophenyl)-(2,5-dimethylphenyl)methanone
CID 43337442
(2-bromo-4-fluorophenyl)-(3,5-dimethylphenyl)methanone
CID 18997592
1-(2-bromo-4-fluorophenyl)-2-(2,5-dimethylphenyl)ethanone
CID 63527175
(3-bromo-2-fluorophenyl)-(2,5-dimethylphenyl)methanone
CID 106647432
(2-bromo-4-fluorophenyl)-(2,4-difluorophenyl)methanone
CID 43160008
N'-(2-bromo-4-fluorobenzoyl)-2,4-dimethylbenzohydrazide
CID 9276694
(2-bromo-4-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339651
(2-bromo-4-fluorophenyl)-(5-methyl-1-benzofuran-2-yl)methanone
CID 115808106
(4-bromothiophen-3-yl)-(2,5-dimethylphenyl)methanone
CID 115784127

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The IUPAC name of (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone (CID 43337277) is (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone.
What is the SMILES notation for (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The canonical SMILES for (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone is Cc1ccc(C)c(C(=O)c2ccc(F)cc2Br)c1.
What is the InChIKey of (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
The InChIKey is DGUHLMYVDSKANA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrFO/c1-9-3-4-10(2)13(7-9)15(18)12-6-5-11(17)8-14(12)16/h3-8H,1-2H3.
What are the key properties of (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone?
(2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone has a molecular weight of 307.16 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4-fluorophenyl)-(2,5-dimethylphenyl)methanone is sourced from PubChem (CID 43337277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).