Basic information
- CAS
53743-43-4- Standard SMILES
O=P(NC12CC3CC(CC(C3)C1)C2)(N1CC1)N1CC1- InChIKey
MXRAUZXJODDPPN-UHFFFAOYSA-N- Molecular formula
- C14H24N3OP
- Average molar mass
- 281.33 g/mol
- Monoisotopic mass
- 281.1656994
Names & identifiers
- Preferred name
- Phosphinic amide, P,P-bis(1-aziridinyl)-N-(1-adamantyl)-
- IUPAC
- N-[bis(aziridin-1-yl)phosphoryl]adamantan-1-amine
- English name
- P,P-Bis(1-aziridinyl)-N-(1-adamantyl)phosphinamide
- Molecular formula
- C14H24N3OP
- Molecular weight
- 281.33
Names & synonyms
53743-43-4Phosphinic amide, P,P-bis(1-aziridinyl)-N-(1-adamantyl)-NSC166199Phosphinic amide, P,P-bis(1-aziridinyl)-N-tricyclo(3.3.1.1(3.7))dec-1-yl-Phosphinic amide, P,P-bis(1-aziridinyl)-N-tricyclo[3.3.1.1(3.7)]dec-1-yl-NSC 166199N-[bis(aziridin-1-yl)phosphoryl]adamantan-1-amineNSC-166199P,P-Bis(1-aziridinyl)-N-(1-adamantyl)-phosphinic amidePhosphinic amide, P,P-bis(1-aziridinyl)-N-tricyclo(3.3.1.1(sup 3,7))dec-1-yl-CHEMBL2006487DTXSID80202020
Show more names
P,P-Bis(1-aziridinyl)-N-(1-adamantyl)phosphinamidePhosphinic amide, P,P-bis(1-aziridinyl)-N-tricyclo[3.3.1.13,7]dec-1-yl- (9CI)
NCI60_001286N-(Adamantan-1-yl)-P,P-bis(aziridin-1-yl)phosphinic amidePhosphinic amide,P-bis(1-aziridinyl)-N-tricyclo[3.3.1.1(3.7)]dec-1-yl-
Database identifiers
- CAS
53743-43-4
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 35.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 400
Experimental & physicochemical properties
LogP1.45
Physicochemical properties
- Boiling point
- 392.9 · 392.9±25.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- pka
- 5.24 · 5.24±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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