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1609-00-3 | Imidodicarbonimidic diamide, N-methyl-
CAS No: 1609-00-3 Catalog No: AG001VGO MDL No:
Product Description
Catalog Number:
AG001VGO
Chemical Name:
Imidodicarbonimidic diamide, N-methyl-
CAS Number:
1609-00-3
Molecular Formula:
C3H9N5
Molecular Weight:
115.1371
IUPAC Name:
1-(diaminomethylidene)-2-methylguanidine
InChI:
InChI=1S/C3H9N5/c1-7-3(6)8-2(4)5/h1H3,(H6,4,5,6,7,8)
InChI Key:
JLPWQEHTPOFCPG-UHFFFAOYSA-N
SMILES:
CNC(=N)NC(=N)N
UNII:
K9BB0L32CH
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.086g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
115.14g/mol
Monoisotopic Mass:
115.086g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
Literature
| Title | Journal |
|---|---|
| Liquid chromatographic/electrospray ionization mass spectrometric identification of the oxidation end-products of metformin in aqueous solutions. | Journal of mass spectrometry : JMS 20040801 |
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