3-(4-Bromobenzoyl)cyclohexane-1-carboxylic acid

HCID 21985708
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Basic information

Standard SMILES
O=C(O)C1CCCC(C(=O)c2ccc(Br)cc2)C1
InChIKey
YPSVTIOENMFRPI-UHFFFAOYSA-N
Molecular formula
C14H15BrO3
Average molar mass
311.17 g/mol

Names & identifiers

Preferred name
3-(4-Bromobenzoyl)cyclohexane-1-carboxylic acid
IUPAC
3-(4-bromobenzoyl)cyclohexane-1-carboxylic acid

Names & synonyms

SCHEMBL1748075

Database identifiers

PubChem CID
21985708

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
54.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18

Related reactions

1 records
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Compound notes

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