Basic information
- CAS
50524-29-3- Standard SMILES
CCOP(=O)(OCC)C1C(C)N1C(=O)Nc1ccccc1- InChIKey
KDAFSJFRCHBLIE-UHFFFAOYSA-N- Molecular formula
- C14H21N2O4P
- Average molar mass
- 312.3 g/mol
- Monoisotopic mass
- 312.12389415
Names & identifiers
- Preferred name
- 2-(Diethoxyphosphoryl)-3-methyl-N-phenylaziridine-1-carboximidic acid
- IUPAC
- 2-diethoxyphosphoryl-3-methyl-N-phenylaziridine-1-carboxamide
Names & synonyms
50524-29-3NSC166198DTXSID909647482-(Diethoxyphosphoryl)-3-methyl-N-phenylaziridine-1-carboximidic acidNSC166197NSC-166197NSC-16619850524-30-6
Database identifiers
- CAS
50524-29-3、50524-30-6- PubChem CID
- 296254
- DTXSID
DTXSID90964748
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 67.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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