Aldophosphamide diethyl acetal
Basic information
- CAS
39947-94-9- Standard SMILES
CCOC(CCOP(N)(=O)N(CCCl)CCCl)OCC- InChIKey
HAUWHFROJHPKIL-UHFFFAOYSA-N- Molecular formula
- C11H25Cl2N2O4P
- Average molar mass
- 351.2 g/mol
- Monoisotopic mass
- 350.0928997
Overview
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Names & identifiers
- Preferred name
- Aldophosphamide diethyl acetal
- IUPAC
- N-[amino(3,3-diethoxypropoxy)phosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine
Names & synonyms
Aldophosphamide diethyl acetalNSC145932SCHEMBL9797175NSC-14593239947-94-9
Database identifiers
- CAS
39947-94-9- PubChem CID
- 286774
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 74 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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