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Home > Nitro Compounds > 88371-88-4
88371-88-4 | 1,5-Diazocine, octahydro-3,3,5,7,7-pentanitro-1-nitroso-
CAS No: 88371-88-4 Catalog No: AG004G0Q MDL No:
Product Description
Catalog Number:
AG004G0Q
Chemical Name:
1,5-Diazocine, octahydro-3,3,5,7,7-pentanitro-1-nitroso-
CAS Number:
88371-88-4
Molecular Formula:
C6H8N8O11
Molecular Weight:
368.1747
IUPAC Name:
1,3,3,7,7-pentanitro-5-nitroso-1,5-diazocane
InChI:
InChI=1S/C6H8N8O11/c15-7-8-1-5(10(16)17,11(18)19)3-9(14(24)25)4-6(2-8,12(20)21)13(22)23/h1-4H2
InChI Key:
KCORQQDMKANXON-UHFFFAOYSA-N
SMILES:
O=NN1CC(CN(CC(C1)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
549
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.031g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.175g/mol
Monoisotopic Mass:
368.031g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
265A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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