1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone

C14H10BrFO — CID 24723944

IUPAC1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone
SMILESO=C(Cc1cccc(F)c1)c1cccc(Br)c1
InChIInChI=1S/C14H10BrFO/c15-12-5-2-4-11(9-12)14(17)8-10-3-1-6-13(16)7-10/h1-7,9H,8H2
InChIKeyINUNYUXLMSXYTA-UHFFFAOYSA-N
MW293.14 g/mol
LogP4.01
Rot. Bonds3

About 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone

1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone (PubChem CID 24723944) has the molecular formula C14H10BrFO and a molecular weight of 293.14 g/mol. Its IUPAC name is 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone.

Molecular Properties

Compound Name1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone
PubChem CID24723944
Molecular FormulaC14H10BrFO
Molecular Weight293.14 g/mol
Exact Mass291.99
IUPAC Name1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone
SMILESO=C(Cc1cccc(F)c1)c1cccc(Br)c1
InChIInChI=1S/C14H10BrFO/c15-12-5-2-4-11(9-12)14(17)8-10-3-1-6-13(16)7-10/h1-7,9H,8H2
InChIKeyINUNYUXLMSXYTA-UHFFFAOYSA-N
XLogP4.01
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.14
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-bromophenyl)-2-(4-bromophenyl)ethanone
CID 55026809
2-(2-bromo-4-fluorophenyl)-1-(3-bromophenyl)ethanone
CID 63411397
1-(3-bromophenyl)-2-(3-chloro-4-fluorophenyl)ethanone
CID 103805205
2-(3-bromophenyl)-1-(4-ethylphenyl)ethanone
CID 60797716
2-(3-fluorophenyl)-1-(3-methoxyphenyl)ethanone
CID 60797583
(3-bromophenyl)-(3-fluorophenyl)methanone
CID 19780750
2-(3-fluorophenyl)-1-(4-sulfanylphenyl)ethanone
CID 155354849
2-(3-fluorophenyl)-1-pyridin-3-ylethanone
CID 60797988
1-(3-bromophenyl)-3-(3-chloro-5-fluorophenyl)propan-1-one
CID 24726555
1-(3-bromophenyl)-2-(5-chloro-2-fluorophenyl)ethanone
CID 103047928
2-(3-bromophenyl)acetic acid;2-(3-fluorophenyl)acetic acid;2-(3-methylphenyl)acetic acid
CID 159192805
1-(3-bromo-5-fluorophenyl)-2-(3-chlorophenyl)ethanone
CID 63526481

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone?
The IUPAC name of 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone (CID 24723944) is 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone.
What is the SMILES notation for 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone?
The canonical SMILES for 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone is O=C(Cc1cccc(F)c1)c1cccc(Br)c1.
What is the InChIKey of 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone?
The InChIKey is INUNYUXLMSXYTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrFO/c15-12-5-2-4-11(9-12)14(17)8-10-3-1-6-13(16)7-10/h1-7,9H,8H2.
What are the key properties of 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone?
1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone has a molecular weight of 293.14 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone is sourced from PubChem (CID 24723944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).