Basic information
- CAS
6964-89-2- Standard SMILES
COC(=O)c1ccc(N2CCOP2(=O)N2CC2)cc1O- InChIKey
KLVUJUTYYQULKT-UHFFFAOYSA-N- Molecular formula
- C12H15N2O5P
- Average molar mass
- 298.23 g/mol
- Monoisotopic mass
- 298.07185858
Names & identifiers
- Preferred name
- Methyl 4-[2-(aziridin-1-yl)-2-oxo-1,3,2lambda5-oxazaphospholidin-3-yl]-2-hydroxybenzoate
- IUPAC
- methyl 4-[2-(aziridin-1-yl)-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]-2-hydroxybenzoate
Names & synonyms
NSC670446964-89-2NSC-67044
Database identifiers
- CAS
6964-89-2- PubChem CID
- 249083
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 79.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 442
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…