Basic information
- Standard SMILES
COC(=O)C1(CCCCCl)CCCC1- InChIKey
VTAMSRIPZXTYNZ-UHFFFAOYSA-N- Molecular formula
- C11H19ClO2
- Average molar mass
- 218.72 g/mol
- Monoisotopic mass
- 218.1073575
Names & identifiers
- Preferred name
- Methyl 1-(4-chlorobutyl)cyclopentane-1-carboxylate
- IUPAC
- methyl 1-(4-chlorobutyl)cyclopentane-1-carboxylate
Names & synonyms
182886-55-1methyl 1-(4-chlorobutyl)cyclopentane-1-carboxylateSCHEMBL6268373VTAMSRIPZXTYNZ-UHFFFAOYSA-NDB-1580021-(4-Chlorobutyl)cyclopentane carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 22633554
- Nikkaji
- J1.632.992D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 186
Related reactions
5 records
Compound notes
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