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1191453-81-2 | 1H-Pyrazol-3-amine, 5-chloro-1-methyl-
CAS No: 1191453-81-2 Catalog No: AG000I93 MDL No:MFCD19207885
Product Description
Catalog Number:
AG000I93
Chemical Name:
1H-Pyrazol-3-amine, 5-chloro-1-methyl-
CAS Number:
1191453-81-2
Molecular Formula:
C4H6ClN3
Molecular Weight:
131.5635
MDL Number:
MFCD19207885
IUPAC Name:
5-chloro-1-methylpyrazol-3-amine
InChI:
InChI=1S/C4H6ClN3/c1-8-3(5)2-4(6)7-8/h2H,1H3,(H2,6,7)
InChI Key:
SEVSLCCFKWIBBN-UHFFFAOYSA-N
SMILES:
Nc1nn(c(c1)Cl)C
Properties
Complexity:
87.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.025g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
131.563g/mol
Monoisotopic Mass:
131.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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