P,P-Bis(1-aziridinyl)-N-butylphosphinic amide

HCID 96085

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Basic information

CAS: 4238-92-0
Standard SMILES: CCCCNP(=O)(N1CC1)N1CC1
InChIKey: OTQJNESRMYNQOR-UHFFFAOYSA-N
Molecular formula: C8H18N3OP
Average molar mass: 203.22 g/mol
Monoisotopic mass: 203.1187492

Names & identifiers

Preferred name: P,P-Bis(1-aziridinyl)-N-butylphosphinic amide
IUPAC: N-[bis(aziridin-1-yl)phosphoryl]butan-1-amine
English name: Bis(1-aziridinyl)(butylamino)phosphine oxide
Molecular formula: C8H18N3OP
Molecular weight: 203.22

Names & synonyms

P,P-Bis(1-aziridinyl)-N-butylphosphinic amide4238-92-0ENT 51028P,P-Di(1-aziridinyl)-N-butylphosphinic amideP,P-Bis(1-aziridinyl)-N-butylaminophosphine oxidePhosphinic amide, P,P-bis(1-aziridinyl)-N-butyl-AI3-51028Butylamino-bis(1-aziridinyl)phosphine oxidePhosphine oxide, bis(1-aziridinyl)butylamino-SBH84ZH22GNSC-51230NSC 51230

Show more names

ENT-51028Bis(1-aziridinyl)(butylamino)phosphine oxide

BRN 1310681p,p-bis(aziridin-1-yl)-n-butylphosphinic amideButylaminobis(1-aziridinyl)phosphine oxideUNII-SBH84ZH22GDTXSID40195186NSC51230WLN: T3NTJ APO&M4&- AT3NTJPhosphinic amide,P-bis(1-aziridinyl)-N-butyl-

Database identifiers

CAS: 4238-92-0
PubChem CID: 96085
DTXSID: DTXSID40195186
UNII: SBH84ZH22G
Nikkaji: J53.769A

Properties

Computed structural properties

XLogP: 0.4
Topological polar surface area: 35.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 6
Heavy atoms: 13
Formal charge: 0
Complexity: 209

Physicochemical properties

FDA UNII: 84 ZH22G · SBH84ZH22G

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