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Home > Nitro Compounds > 88106-06-3
88106-06-3 | Acetamide, N,N'-(2,4,6-trinitro-1,3-phenylene)bis-
CAS No: 88106-06-3 Catalog No: AG004ISP MDL No:
Product Description
Catalog Number:
AG004ISP
Chemical Name:
Acetamide, N,N'-(2,4,6-trinitro-1,3-phenylene)bis-
CAS Number:
88106-06-3
Molecular Formula:
C10H9N5O8
Molecular Weight:
327.2072
IUPAC Name:
N-(3-acetamido-2,4,6-trinitrophenyl)acetamide
InChI:
InChI=1S/C10H9N5O8/c1-4(16)11-8-6(13(18)19)3-7(14(20)21)9(12-5(2)17)10(8)15(22)23/h3H,1-2H3,(H,11,16)(H,12,17)
InChI Key:
HVDCMVWRULMAQL-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1c(cc(c(c1[N+](=O)[O-])NC(=O)C)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.045g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
327.209g/mol
Monoisotopic Mass:
327.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
196A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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