1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone

C14H11BrO2 — CID 123191704

IUPAC1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone
SMILESO=C(CO)c1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H11BrO2/c15-13-7-5-11(6-8-13)10-1-3-12(4-2-10)14(17)9-16/h1-8,16H,9H2
InChIKeyZYIFGIFVEWZVGW-UHFFFAOYSA-N
MW291.14 g/mol
LogP3.29
Rot. Bonds3

About 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone

1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone (PubChem CID 123191704) has the molecular formula C14H11BrO2 and a molecular weight of 291.14 g/mol. Its IUPAC name is 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone.

Molecular Properties

Compound Name1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone
PubChem CID123191704
Molecular FormulaC14H11BrO2
Molecular Weight291.14 g/mol
Exact Mass289.99
IUPAC Name1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone
SMILESO=C(CO)c1ccc(-c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H11BrO2/c15-13-7-5-11(6-8-13)10-1-3-12(4-2-10)14(17)9-16/h1-8,16H,9H2
InChIKeyZYIFGIFVEWZVGW-UHFFFAOYSA-N
XLogP3.29
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[4-(4-bromophenyl)phenyl]-2-oxoethyl]-dimethylazanium
CID 140658009
sodium;2-bromo-1-(4-bromophenyl)ethanone;1-(4-bromophenyl)-2-hydroxyethanone;acetate
CID 159147528
2-(bromoamino)-1-(4-bromophenyl)ethanone
CID 86670861
1-(4-bromophenyl)-2-phosphanylethanone;hydrobromide
CID 173013220
[2-[4-(4-bromophenyl)phenyl]-2-oxoethyl] 4-(hydroxymethyl)benzoate
CID 18275085
1-(4-bromophenyl)-2-(tribromo-λ4-tellanyl)ethanone
CID 134926841
1-(4-bromophenyl)-2-(4-phenylphenoxy)ethanone
CID 4309178
1-[4-(4-bromophenyl)phenyl]-4-(dimethylamino)butan-1-one chloride
CID 57388918
4-(2-hydroxyacetyl)benzoyl chloride
CID 89280551
1-(4-aminophenyl)-2-hydroxyethanone
CID 19755805
1-[4-(2-fluoroacetyl)phenyl]-2-hydroxyethanone
CID 58149469
2-[4-(4-bromophenyl)phenyl]-2-oxoacetaldehyde
CID 39233469

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone?
The IUPAC name of 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone (CID 123191704) is 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone.
What is the SMILES notation for 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone?
The canonical SMILES for 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone is O=C(CO)c1ccc(-c2ccc(Br)cc2)cc1.
What is the InChIKey of 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone?
The InChIKey is ZYIFGIFVEWZVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrO2/c15-13-7-5-11(6-8-13)10-1-3-12(4-2-10)14(17)9-16/h1-8,16H,9H2.
What are the key properties of 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone?
1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone has a molecular weight of 291.14 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-bromophenyl)phenyl]-2-hydroxyethanone is sourced from PubChem (CID 123191704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).