Phosphonic acid, (aminocyanomethyl)-, diethyl ester
Basic information
- CAS
69907-48-8- Standard SMILES
CCOP(=O)(OCC)C(N)C#N- InChIKey
PBWNQPLPIXXHGN-UHFFFAOYSA-N- Molecular formula
- C6H13N2O3P
- Average molar mass
- 192.15 g/mol
- Monoisotopic mass
- 192.06637928
Names & identifiers
- Preferred name
- Phosphonic acid, (aminocyanomethyl)-, diethyl ester
- IUPAC
- 2-amino-2-diethoxyphosphorylacetonitrile
Names & synonyms
Phosphonic acid, (aminocyanomethyl)-, diethyl ester69907-48-8DTXSID20316852RefChem:370513DTXCID60267975Diethyl [amino(cyano)methyl]phosphonate
Database identifiers
- CAS
69907-48-8- PubChem CID
- 328602
- DTXSID
DTXSID20316852
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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