Propanoic acid, 2,2-dichloro-, decyl ester
Basic information
- CAS
89876-41-5- Standard SMILES
CCCCCCCCCCOC(=O)C(C)(Cl)Cl- InChIKey
HCPBEFHGQZVRQJ-UHFFFAOYSA-N- Molecular formula
- C13H24Cl2O2
- Average molar mass
- 283.2 g/mol
- Monoisotopic mass
- 282.1153354
Names & identifiers
- Preferred name
- Propanoic acid, 2,2-dichloro-, decyl ester
- IUPAC
- decyl 2,2-dichloropropanoate
Names & synonyms
Propanoic acid, 2,2-dichloro-, decyl ester89876-41-5DECYL 2,2-DICHLOROPROPANOATEDTXSID90335919
Database identifiers
- CAS
89876-41-5- PubChem CID
- 527992
- DTXSID
DTXSID90335919
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 206
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Compound notes
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