Ethyl 7-chloro-3-oxoheptanoate
Basic information
- Standard SMILES
CCOC(=O)CC(=O)CCCCCl- InChIKey
OXPOIABOXLXYKI-UHFFFAOYSA-N- Molecular formula
- C9H15ClO3
- Average molar mass
- 206.66 g/mol
Names & identifiers
- Preferred name
- Ethyl 7-chloro-3-oxoheptanoate
- IUPAC
- ethyl 7-chloro-3-oxoheptanoate
Names & synonyms
Ethyl 7-chloro-3-oxoheptanoate99054-01-0MFCD24458865Ethyl7-chloro-3-oxoheptanoateSCHEMBL5193775ethyl 7-chloro-3-oxo-heptanoateOXPOIABOXLXYKI-UHFFFAOYSA-NAKOS037644108AB225227-chloro-3-oxoheptanoic acid ethyl esterAS-44633F539966
Database identifiers
- PubChem CID
- 13612450
- Nikkaji
- J2.980.150I
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
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Related reactions
10 records
Compound notes
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