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Home > Nitro Compounds > 88061-84-1
88061-84-1 | Acetamide, N-[1-(dinitromethyl)-2(1H)-pyridinylidene]-
CAS No: 88061-84-1 Catalog No: AG004IEA MDL No:
Product Description
Catalog Number:
AG004IEA
Chemical Name:
Acetamide, N-[1-(dinitromethyl)-2(1H)-pyridinylidene]-
CAS Number:
88061-84-1
Molecular Formula:
C8H8N4O5
Molecular Weight:
240.1729
IUPAC Name:
N-[1-(dinitromethyl)pyridin-2-ylidene]acetamide
InChI:
InChI=1S/C8H8N4O5/c1-6(13)9-7-4-2-3-5-10(7)8(11(14)15)12(16)17/h2-5,8H,1H3
InChI Key:
OFUNRUHRTIRXGO-UHFFFAOYSA-N
SMILES:
CC(=O)N=c1ccccn1C([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.049g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.175g/mol
Monoisotopic Mass:
240.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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