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Home > Nitro Compounds > 13830-58-5
13830-58-5 | Guanidine, N-methyl-N'-nitroso-
CAS No: 13830-58-5 Catalog No: AG0018HC MDL No:
Product Description
Catalog Number:
AG0018HC
Chemical Name:
Guanidine, N-methyl-N'-nitroso-
CAS Number:
13830-58-5
Molecular Formula:
C2H6N4O
Molecular Weight:
102.0952
IUPAC Name:
2-methyl-1-nitrosoguanidine
InChI:
InChI=1S/C2H6N4O/c1-4-2(3)5-6-7/h1H3,(H3,3,4,5,7)
InChI Key:
DMSDCBKFWUBTKX-UHFFFAOYSA-N
SMILES:
CNC(=N)NN=O
UNII:
41916PN6FI
NSC Number:
30908
Properties
Complexity:
87.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
102.054g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
102.097g/mol
Monoisotopic Mass:
102.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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