Basic information
- CAS
21310-38-3- Standard SMILES
CCOP(=O)(CCl)CCC#N- InChIKey
BFAXBTSWGFBFAO-UHFFFAOYSA-N- Molecular formula
- C6H11ClNO2P
- Average molar mass
- 195.58 g/mol
- Monoisotopic mass
- 195.0215933
Names & identifiers
- Preferred name
- Ethyl (chloromethyl)(2-cyanoethyl)-phosphinate
- IUPAC
- 3-[chloromethyl(ethoxy)phosphoryl]propanenitrile
Names & synonyms
ETHYL (CHLOROMETHYL)(2-CYANOETHYL)-PHOSPHINATE21310-38-3Ethyl (chloromethyl)(2-cyanoethyl)phosphinateDTXSID80943820
Database identifiers
- CAS
21310-38-3- PubChem CID
- 30588
- DTXSID
DTXSID80943820- Nikkaji
- J1.609.243F
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 198
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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