Chloromethyl 3-chlorododecanoate
Basic information
- CAS
80418-99-1- Standard SMILES
CCCCCCCCCC(Cl)CC(=O)OCCl- InChIKey
GQHFPKLBEGPYQL-UHFFFAOYSA-N- Molecular formula
- C13H24Cl2O2
- Average molar mass
- 283.2 g/mol
- Monoisotopic mass
- 282.1153354
Names & identifiers
- Preferred name
- Chloromethyl 3-chlorododecanoate
- IUPAC
- chloromethyl 3-chlorododecanoate
Names & synonyms
Chloromethyl 3-chlorododecanoate80418-99-13-Chlorododecanoic acid, chloromethyl esterDTXSID60336791RefChem:333827DTXCID00287879GQHFPKLBEGPYQL-UHFFFAOYSA-N
Database identifiers
- CAS
80418-99-1- PubChem CID
- 536376
- DTXSID
DTXSID60336791
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 186
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…