Hexaphosphamide
Basic information
- CAS
3054-21-5- Standard SMILES
S=P(NC1CCCCC1)(N1CC1)N1CC1- InChIKey
RDAHFZJUOCJYHC-UHFFFAOYSA-N- Molecular formula
- C10H20N3PS
- Average molar mass
- 245.33 g/mol
- Monoisotopic mass
- 245.11155582
Overview
structure
Names & identifiers
- Preferred name
- Hexaphosphamide
- IUPAC
- N-[bis(aziridin-1-yl)phosphinothioyl]cyclohexanamine
- English name
- hexaphosphamide
- Molecular formula
- C10H20N3PS
- Molecular weight
- 245.32
Names & synonyms
HexaphosphamideHexafosfamid3054-21-5P,P-Bis(1-aziridinyl)-N-cyclohexylphosphinothioic amideNSC-64347HU388LSE5QAI3-62488Phosphinothioic amide, P,P-bis(1-aziridinyl)-N-cyclohexyl-DTXSID301846201,1'-(cyclohexylaminophosphinothioyliden)diaziridineRefChem:146270DTXCID70107111
Show more names
ENT62488Bis(1-aziridinyl)(cyclohexylamino)phosphine sulfidePhosphinothioic amide, P,P-bis(1-aziridinyl)-N-cyclohexyl- (7CI,8CI,9CI)
MLS000766213ENT 62488NSC 64347BRN 1346167N,N'-Di-(ethyleneimide)-N''-cyclohexylamide of thiophosphoric acidNCIOpen2_0030075-20-01-00130 (Beilstein Handbook Reference)CHEMBL451261
Database identifiers
- CAS
3054-21-5- PubChem CID
- 96272
- DTXSID
DTXSID30184620- ChEMBL
CHEMBL451261- UNII
- HU388LSE5Q
- Nikkaji
- J85.590A
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Physicochemical properties
- FDA UNII
- 388 LSE5Q · HU388LSE5Q
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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