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1192-21-8 | 1H-Pyrazol-5-amine, 1-methyl-
CAS No: 1192-21-8 Catalog No: AG000IBV MDL No:MFCD00068156
Product Description
Catalog Number:
AG000IBV
Chemical Name:
1H-Pyrazol-5-amine, 1-methyl-
CAS Number:
1192-21-8
Molecular Formula:
C4H7N3
Molecular Weight:
97.1185
MDL Number:
MFCD00068156
IUPAC Name:
2-methylpyrazol-3-amine
InChI:
InChI=1S/C4H7N3/c1-7-4(5)2-3-6-7/h2-3H,5H2,1H3
InChI Key:
JESRNIJXVIFVOV-UHFFFAOYSA-N
SMILES:
Cn1nccc1N
NSC Number:
76510
Properties
Complexity:
64
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.064g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
97.121g/mol
Monoisotopic Mass:
97.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR of novel parenteral anti-pseudomonal cephalosporins: discovery of FR264205. | Bioorganic & medicinal chemistry letters 20080901 |
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