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Home > Nitro Compounds > 138090-34-3
138090-34-3 | Guanidine, N,N'-dimethyl-N''-nitro-N-nitroso- (9CI)
CAS No: 138090-34-3 Catalog No: AG0017Z9 MDL No:
Product Description
Catalog Number:
AG0017Z9
Chemical Name:
Guanidine, N,N'-dimethyl-N''-nitro-N-nitroso- (9CI)
CAS Number:
138090-34-3
Molecular Formula:
C3H7N5O3
Molecular Weight:
161.1194
IUPAC Name:
1,3-dimethyl-1-nitro-3-nitrosoguanidine
InChI:
InChI=1S/C3H7N5O3/c1-6(5-9)3(4)7(2)8(10)11/h4H,1-2H3
InChI Key:
LMKBXLPUBXJKLX-UHFFFAOYSA-N
SMILES:
O=NN(C(=N[N+](=O)[O-])NC)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.055g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.121g/mol
Monoisotopic Mass:
161.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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