Basic information
- Standard SMILES
COC(=O)C1CCC(OCCCCOCc2ccccc2)CC1- InChIKey
VOFKGSSDISYLTE-UHFFFAOYSA-N- Molecular formula
- C19H28O4
- Average molar mass
- 320.4 g/mol
Names & identifiers
- Preferred name
- cis-4-(4-Benzyloxy-butoxy)-cyclohexanecarboxylic acid methyl ester
- IUPAC
- methyl 4-(4-phenylmethoxybutoxy)cyclohexane-1-carboxylate
Names & synonyms
SCHEMBL6018928SCHEMBL6018931SCHEMBL6019299VOFKGSSDISYLTE-HDICACEKSA-Ncis-4-(4-benzyloxy-butoxy)-cyclohexanecarboxylic acid methyl ester
Database identifiers
- PubChem CID
- 69638428
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 317
Related reactions
2 records
Compound notes
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