Basic information
- CAS
80418-86-6- Standard SMILES
CC(Cl)CCCCCCCC(=O)OCCl- InChIKey
KPSTVHFMJIDEGU-UHFFFAOYSA-N- Molecular formula
- C11H20Cl2O2
- Average molar mass
- 255.18 g/mol
- Monoisotopic mass
- 254.0840353
Names & identifiers
- Preferred name
- Chloromethyl 9-chlorodecanoate
- IUPAC
- chloromethyl 9-chlorodecanoate
Names & synonyms
Chloromethyl 9-chlorodecanoate80418-86-69-Chlorodecanoic acid, chloromethyl esterDTXSID40337640RefChem:333867DTXCID20288727KPSTVHFMJIDEGU-UHFFFAOYSA-N
Database identifiers
- CAS
80418-86-6- PubChem CID
- 543788
- DTXSID
DTXSID40337640
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 163
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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