Basic information
- CAS
1059-45-6- Standard SMILES
O=P1(Nc2ccc(Cl)cc2)N(Cc2ccc(Cl)cc2)CCCN1Cc1ccc(Cl)cc1- InChIKey
MZNTWSMWROXUKV-UHFFFAOYSA-N- Molecular formula
- C23H23Cl3N3OP
- Average molar mass
- 494.8 g/mol
- Monoisotopic mass
- 493.064432
Names & identifiers
- Preferred name
- N-(4-chlorophenyl)-1,3-bis[(4-chlorophenyl)methyl]-2-oxo-1,3,2lambda5-diazaphosphinan-2-amine
- IUPAC
- N-(4-chlorophenyl)-1,3-bis[(4-chlorophenyl)methyl]-2-oxo-1,3,2λ5-diazaphosphinan-2-amine
Names & synonyms
NSC671651059-45-6DTXSID50328903NSC-671652-(4-Chloroanilino)-1,3-bis[(4-chlorophenyl)methyl]-1,3,2lambda~5~-diazaphosphinan-2-one
Database identifiers
- CAS
1059-45-6- PubChem CID
- 415142
- DTXSID
DTXSID50328903
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 567
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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