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14085-41-7 | 3-Phenyl-1-(propan-2-yl)-1H-pyrazol-5-amine
CAS No: 14085-41-7 Catalog No: AG01FAYR MDL No:
Product Description
Catalog Number:
AG01FAYR
Chemical Name:
3-Phenyl-1-(propan-2-yl)-1H-pyrazol-5-amine
CAS Number:
14085-41-7
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
IUPAC Name:
5-phenyl-2-propan-2-ylpyrazol-3-amine
InChI:
InChI=1S/C12H15N3/c1-9(2)15-12(13)8-11(14-15)10-6-4-3-5-7-10/h3-9H,13H2,1-2H3
InChI Key:
BCLGGAULDBHZDU-UHFFFAOYSA-N
SMILES:
CC(n1nc(cc1N)c1ccccc1)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.127g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.273g/mol
Monoisotopic Mass:
201.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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