Basic information
- CAS
19341-53-8- Standard SMILES
O=P1(Nc2ccc(Cl)cc2)OCC2(CO1)COP(=O)(Nc1ccc(Cl)cc1)OC2- InChIKey
ZUIPPSKEQCFEKO-UHFFFAOYSA-N- Molecular formula
- C17H18Cl2N2O6P2
- Average molar mass
- 479.2 g/mol
- Monoisotopic mass
- 478.0017157
Names & identifiers
- Preferred name
- n,n'-Bis(4-chlorophenyl)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane-3,9-diamine 3,9-dioxide
- IUPAC
- 3-N,9-N-bis(4-chlorophenyl)-3,9-dioxo-2,4,8,10-tetraoxa-3λ5,9λ5-diphosphaspiro[5.5]undecane-3,9-diamine
Names & synonyms
19341-53-8NSC105524n,n'-bis(4-chlorophenyl)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane-3,9-diamine 3,9-dioxideDTXSID40295791NSC-1055243,9-Bis(4-chloroanilino)-2,4,8,10-tetraoxa-3lambda~5~,9lambda~5~-diphosphaspiro[5.5]undecane-3,9-dione
Database identifiers
- CAS
19341-53-8- PubChem CID
- 266751
- DTXSID
DTXSID40295791
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 587
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…