1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-4,6-bis(dimethylamino)-2,2,4,6-tetrakis(1-aziridinyl)-
Basic information
- CAS
3776-20-3- Standard SMILES
CN(C)P1(N2CC2)=NP(N(C)C)(N2CC2)=NP(N2CC2)(N2CC2)=N1- InChIKey
QHGDRCKEZYQEMT-UHFFFAOYSA-N- Molecular formula
- C12H28N9P3
- Average molar mass
- 391.33 g/mol
- Monoisotopic mass
- 391.16805292
Names & identifiers
- Preferred name
- 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-4,6-bis(dimethylamino)-2,2,4,6-tetrakis(1-aziridinyl)-
- IUPAC
- 2,4,6,6-tetrakis(aziridin-1-yl)-2-N,2-N,4-N,4-N-tetramethyl-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene-2,4-diamine
Names & synonyms
3776-20-31,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-4,6-bis(dimethylamino)-2,2,4,6-tetrakis(1-aziridinyl)-RefChem:217099SCHEMBL21875601DTXSID009588102,4-Bis(dimethylamino)-2,4,6,6-tetrakis(aziridin-1-yl)cyclotriphosphazene2,4-Bis(aziridin-1-yl)-6,6-bis(aziridin-1-yl)-N~2~,N~2~,N~4~,N~4~-tetramethyl-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine-2,4-diamine
Database identifiers
- CAS
3776-20-3- PubChem CID
- 199158
- DTXSID
DTXSID00958810
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 664
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Compound notes
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