Ethyl 13-(acetyloxy)-2-chlorotridecanoate
Basic information
- CAS
6678-50-8- Standard SMILES
CCOC(=O)C(Cl)CCCCCCCCCCCOC(C)=O- InChIKey
OLHCLGLNEONQIF-UHFFFAOYSA-N- Molecular formula
- C17H31ClO4
- Average molar mass
- 334.9 g/mol
- Monoisotopic mass
- 334.1910872
Names & identifiers
- Preferred name
- Ethyl 13-(acetyloxy)-2-chlorotridecanoate
- IUPAC
- ethyl 13-acetyloxy-2-chlorotridecanoate
Names & synonyms
Ethyl 13-(acetyloxy)-2-chlorotridecanoate6678-50-8DTXSID10411547AKOS024340952
Database identifiers
- CAS
6678-50-8- PubChem CID
- 5227722
- DTXSID
DTXSID10411547
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 294
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Compound notes
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