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10199-50-5 | 1H-Pyrazol-5-amine, 1-methyl-3-phenyl-
CAS No: 10199-50-5 Catalog No: AG000665 MDL No:MFCD00067874
Product Description
Catalog Number:
AG000665
Chemical Name:
1H-Pyrazol-5-amine, 1-methyl-3-phenyl-
CAS Number:
10199-50-5
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD00067874
IUPAC Name:
2-methyl-5-phenylpyrazol-3-amine
InChI:
InChI=1S/C10H11N3/c1-13-10(11)7-9(12-13)8-5-3-2-4-6-8/h2-7H,11H2,1H3
InChI Key:
KCYRMURRLLYLPU-UHFFFAOYSA-N
SMILES:
Cn1nc(cc1N)c1ccccc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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