Methyl 4-phenylcyclohexane-1-carboxylate

HCID 754723
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Basic information

Standard SMILES
COC(=O)C1CCC(c2ccccc2)CC1
InChIKey
APZUMPUMIRTOSP-UHFFFAOYSA-N
Molecular formula
C14H18O2
Average molar mass
218.29 g/mol
Monoisotopic mass
218.13067981

Names & identifiers

Preferred name
Methyl 4-phenylcyclohexane-1-carboxylate
IUPAC
methyl 4-phenylcyclohexane-1-carboxylate

Names & synonyms

331671-53-5methyl 4-phenylcyclohexane-1-carboxylateCBMicro_016625SCHEMBL181066SCHEMBL3540595APZUMPUMIRTOSP-JOCQHMNTSA-NAPZUMPUMIRTOSP-UHFFFAOYSA-NCCG-5496methyl-4-phenylcyclohexane carboxylateAKOS000618724BIM-0016510.P001Methyl trans-4-phenylcyclohexanecarboxylate
Show more names
Cyclohexanecarboxylic acid, 4-phenyl-, methyl estertrans-4-phenylcyclohexanecarboxylic acid methyl ester

Database identifiers

PubChem CID
754723
Nikkaji
J1.630.098E

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
16

Related reactions

5 records
New reaction record

Compound notes

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