1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone

C15H11BrF2O — CID 105376889

IUPAC1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
SMILESCc1ccc(F)cc1CC(=O)c1cc(F)ccc1Br
InChIInChI=1S/C15H11BrF2O/c1-9-2-3-11(17)6-10(9)7-15(19)13-8-12(18)4-5-14(13)16/h2-6,8H,7H2,1H3
InChIKeyDGDVAMPUYHGASP-UHFFFAOYSA-N
MW325.15 g/mol
LogP4.46
Rot. Bonds3

About 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone

1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone (PubChem CID 105376889) has the molecular formula C15H11BrF2O and a molecular weight of 325.15 g/mol. Its IUPAC name is 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
PubChem CID105376889
Molecular FormulaC15H11BrF2O
Molecular Weight325.15 g/mol
Exact Mass324.00
IUPAC Name1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
SMILESCc1ccc(F)cc1CC(=O)c1cc(F)ccc1Br
InChIInChI=1S/C15H11BrF2O/c1-9-2-3-11(17)6-10(9)7-15(19)13-8-12(18)4-5-14(13)16/h2-6,8H,7H2,1H3
InChIKeyDGDVAMPUYHGASP-UHFFFAOYSA-N
XLogP4.46
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.15
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-5-methylphenyl)-2-(2,5-difluorophenyl)ethanone
CID 114964013
1-(2-bromo-4-fluorophenyl)-2-(2,5-dimethylphenyl)ethanone
CID 63527175
1-(3-bromo-4-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105376772
1-(2-bromo-5-fluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanone
CID 115800218
1-(4-bromophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373145
2-(5-fluoro-2-methylphenyl)-1-(2-fluorophenyl)ethanone
CID 105373215
1-(2-bromo-4-fluorophenyl)-2-(2-bromo-5-fluorophenyl)ethanone
CID 114968179
1-(2-bromo-5-iodophenyl)-2-(2,5-difluorophenyl)ethanone
CID 114026781
1-(3-bromo-2-pyridinyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373365
1-(4-bromo-3,5-dimethylphenyl)-2-(2-bromo-5-fluorophenyl)ethanone
CID 114329547
2-(2-bromo-5-fluorophenyl)-1-(1,5-dimethylpyrazol-4-yl)ethanone
CID 105090170
1-(2-bromo-5-fluorophenyl)ethanone
CID 22736080

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The IUPAC name of 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone (CID 105376889) is 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone.
What is the SMILES notation for 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The canonical SMILES for 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone is Cc1ccc(F)cc1CC(=O)c1cc(F)ccc1Br.
What is the InChIKey of 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The InChIKey is DGDVAMPUYHGASP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrF2O/c1-9-2-3-11(17)6-10(9)7-15(19)13-8-12(18)4-5-14(13)16/h2-6,8H,7H2,1H3.
What are the key properties of 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone has a molecular weight of 325.15 g/mol, XLogP of 4.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone is sourced from PubChem (CID 105376889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).