(1-Hydroxycyclohexyl)-(4-methoxyphenyl)methanone
Basic information
- CAS
7469-82-1- Standard SMILES
COc1ccc(C(=O)C2(O)CCCCC2)cc1- InChIKey
VZBYKVQADRDMAP-UHFFFAOYSA-N- Molecular formula
- C14H18O3
- Average molar mass
- 234.29 g/mol
- Monoisotopic mass
- 234.12559443
Names & identifiers
- Preferred name
- (1-Hydroxycyclohexyl)-(4-methoxyphenyl)methanone
- IUPAC
- (1-hydroxycyclohexyl)-(4-methoxyphenyl)methanone
- English name
- Methanone,(1-hydroxycyclohexyl)(4-Methoxyphenyl)-
- Molecular formula
- C14H18O3
- Molecular weight
- 234.29
Names & synonyms
(1-hydroxycyclohexyl)-(4-methoxyphenyl)methanone7469-82-1DTXSID40322879RefChem:204546DTXCID40273998(1-hydroxycyclohexyl)(4-methoxyphenyl)methanoneNSC402219SCHEMBL28669997NSC-402219Methanone,(1-hydroxycyclohexyl)(4-Methoxyphenyl)-
Database identifiers
- CAS
7469-82-1- PubChem CID
- 345016
- DTXSID
DTXSID40322879
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
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Compound notes
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