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16675-35-7 | 1H-Pyrazole-3,5-diamine, 1-methyl-
CAS No: 16675-35-7 Catalog No: AG001WXK MDL No:MFCD14607840
Product Description
Catalog Number:
AG001WXK
Chemical Name:
1H-Pyrazole-3,5-diamine, 1-methyl-
CAS Number:
16675-35-7
Molecular Formula:
C4H8N4
Molecular Weight:
112.1331
MDL Number:
MFCD14607840
IUPAC Name:
1-methylpyrazole-3,5-diamine
InChI:
InChI=1S/C4H8N4/c1-8-4(6)2-3(5)7-8/h2H,6H2,1H3,(H2,5,7)
InChI Key:
WKMWPNCWMKQIER-UHFFFAOYSA-N
SMILES:
Nc1cc(n(n1)C)N
Properties
Complexity:
84.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.075g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
112.136g/mol
Monoisotopic Mass:
112.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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