Basic information
- CAS
78994-11-3- Standard SMILES
[N-]=[N+]=NP1(=O)OC(c2ccccc2)=CCN1c1ccccc1- InChIKey
DFOMIQWZCLKTLU-UHFFFAOYSA-N- Molecular formula
- C15H13N4O2P
- Average molar mass
- 312.26 g/mol
- Monoisotopic mass
- 312.07761267
Names & identifiers
- Preferred name
- Agn-PC-0L2mtw
- IUPAC
- 2-azido-3,6-diphenyl-4H-1,3,2λ5-oxazaphosphinine 2-oxide
Names & synonyms
78994-11-3AGN-PC-0L2MTWDTXSID70398143NSC337842NSC-3378422-Azido-3,6-diphenyl-3,4-dihydro-2H-1,3,2lambda~5~-oxazaphosphinin-2-one
Database identifiers
- CAS
78994-11-3- PubChem CID
- 3944802
- DTXSID
DTXSID70398143
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 518
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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