AC1L6KB1

2-N-benzyl-5-methyl-2-oxo-1,3,2λ5-dioxaphosphinane-2,5-diamine;5-ethyl-2-hydroxy-5-nitro-1,3,2λ5-dioxaphosphinane 2-oxide

Also Known As: 2-N-benzyl-5-methyl-2-oxo-1,3,2|2-N-benzyl-5-methyl-2-oxo-1,3,2lambda5-dioxaphosphinane-2,5-diami|5-ethyl-5-nitro-1,3,2-dioxaphosphinan-2-ol 2-oxide- n2-benzyl-5-methyl-1,3,2-dioxaphosphinane-2,5-diamine 2-oxide(1:1)|2-N-benzyl-5-methyl-2-oxo-1,3,2lambda5-dioxaphosphinane-2,5-diamine;5-ethyl-2-hydroxy-5-nitro-1,3,2lambda5-dioxaphosphinane 2-oxide|5-Amino-2-(benzylamino)-5-methyl-1,3,2lambda~5~-dioxaphosphinan-2-one--5-ethyl-2-hydroxy-5-nitro-1,3,2lambda~5~-dioxaphosphinan-2-one (1/1)

Molecular Formula	C16H27N3O9P2
Molecular Weight	467.12225 g/mol
LogP	2.2076
Topological Polar Surface Area	175.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	11
Rotatable Bonds	4
Exact Mass	467.12225
Monoisotopic Mass	467.12225
Heavy Atoms	30
Complexity	541.0

Chemical Identifiers

CAS Number	20133-72-6
SMILES	CCC1(COP(=O)(OC1)O)[N+](=O)[O-].CC1(COP(=O)(OC1)NCC2=CC=CC=C2)N
InChIKey	CCVUAXCQDXGBNF-UHFFFAOYSA-N