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15967-75-6 | 1H-Pyrazole, 1-ethenyl-3,5-dimethyl-
CAS No: 15967-75-6 Catalog No: AG001RAZ MDL No:
Product Description
Catalog Number:
AG001RAZ
Chemical Name:
1H-Pyrazole, 1-ethenyl-3,5-dimethyl-
CAS Number:
15967-75-6
Molecular Formula:
C7H10N2
Molecular Weight:
122.1677
IUPAC Name:
1-ethenyl-3,5-dimethylpyrazole
InChI:
InChI=1S/C7H10N2/c1-4-9-7(3)5-6(2)8-9/h4-5H,1H2,2-3H3
InChI Key:
PWHCXMAJNAYEOR-UHFFFAOYSA-N
SMILES:
Cc1cc(nn1C=C)C
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.171g/mol
Monoisotopic Mass:
122.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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