2-[Bis(2-chloroethyl)amino]-2-oxo-1,3,2lambda~5~-oxazaphosphinane-4-carbonitrile
Basic information
- CAS
84489-10-1- Standard SMILES
N#CC1CCOP(=O)(N(CCCl)CCCl)N1- InChIKey
OGYKCONLWDMECG-UHFFFAOYSA-N- Molecular formula
- C8H14Cl2N3O2P
- Average molar mass
- 286.09 g/mol
- Monoisotopic mass
- 285.0200691
Names & identifiers
- Preferred name
- 2-[Bis(2-chloroethyl)amino]-2-oxo-1,3,2lambda~5~-oxazaphosphinane-4-carbonitrile
- IUPAC
- 2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2λ5-oxazaphosphinane-4-carbonitrile
Names & synonyms
84489-10-1NSC301733DTXSID10316301NSC301734NSC-301733NSC-3017342-[Bis(2-chloroethyl)amino]-2-oxo-1,3,2lambda~5~-oxazaphosphinane-4-carbonitrile
Database identifiers
- CAS
84489-10-1- PubChem CID
- 327290
- DTXSID
DTXSID10316301
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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