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1175899-74-7 | 5-amino-1-(4-isopropylphenyl)-1H-pyrazole-4-carbonitrile
CAS No: 1175899-74-7 Catalog No: AG01FFP0 MDL No:
Product Description
Catalog Number:
AG01FFP0
Chemical Name:
5-amino-1-(4-isopropylphenyl)-1H-pyrazole-4-carbonitrile
CAS Number:
1175899-74-7
IUPAC Name:
5-amino-1-(4-propan-2-ylphenyl)pyrazole-4-carbonitrile
InChI:
InChI=1S/C13H14N4/c1-9(2)10-3-5-12(6-4-10)17-13(15)11(7-14)8-16-17/h3-6,8-9H,15H2,1-2H3
InChI Key:
QVGYSLPAHYVSFV-UHFFFAOYSA-N
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.122g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.283g/mol
Monoisotopic Mass:
226.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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