Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)
Basic information
- CAS
62654-09-5- Standard SMILES
N#CCCOP(=O)(O)O.NC1CCCCC1.NC1CCCCC1- InChIKey
QSDZRMXWHBMBOP-UHFFFAOYSA-N- Molecular formula
- C15H32N3O4P
- Average molar mass
- 349.41 g/mol
- Monoisotopic mass
- 349.21304351
Names & identifiers
- Preferred name
- Propanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2)
- IUPAC
- 2-cyanoethyl dihydrogen phosphate;bis(cyclohexanamine)
Names & synonyms
62654-09-5DTXSID70886499EINECS 263-674-7RefChem:176315DTXCID001025823Bis(cyclohexylammonium) 2-cyanoethyl phosphate2-Cyanoethyl dihydrogen phosphate--cyclohexanamine (1/2)
Database identifiers
- CAS
62654-09-5- PubChem CID
- 112907
- DTXSID
DTXSID70886499- EC Number
- 263-674-7
Properties
Computed structural properties
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 210
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropanenitrile, 3-(phosphonooxy)-, compd. with cyclohexanamine (1:2): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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