Basic information
- CAS
15501-45-8- Standard SMILES
COP(=O)(OC)C(O)C(Cl)Cl- InChIKey
SJZJHMWQLCCOOR-UHFFFAOYSA-N- Molecular formula
- C4H9Cl2O4P
- Average molar mass
- 222.99 g/mol
- Monoisotopic mass
- 221.9615511
Names & identifiers
- Preferred name
- Phosphonic acid, (2,2-dichloro-1-hydroxyethyl)-, dimethyl ester
- IUPAC
- 2,2-dichloro-1-dimethoxyphosphorylethanol
Names & synonyms
15501-45-8Phosphonic acid, (2,2-dichloro-1-hydroxyethyl)-, dimethyl esterRefChem:1095147O,O-Dimethyl 2,2-dichloro-1-hydroxyethylphosphonateNS 2662NSC 172810AI3-20743(2,2-Dichloro-1-hydroxyethyl)phosphonic acid dimethyl esterDTXSID401385009NSC172810NSC-172810
Database identifiers
- CAS
15501-45-8- PubChem CID
- 99092
- DTXSID
DTXSID401385009
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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