3H-Pyrazol-3-one, 2-(3,4-dimethylphenyl)-2,4-dihydro-5-methyl-


Chemical Name: 3H-Pyrazol-3-one, 2-(3,4-dimethylphenyl)-2,4-dihydro-5-methyl-
CAS Number: 18048-64-1
Product Number: AG00220Z(AGN-PC-0KZ1J9)
Synonyms:
MDL No:
Molecular Formula: C12H14N2O
Molecular Weight: 202.2524

Identification/Properties


Computed Properties
Molecular Weight:
202.257g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
202.111g/mol
Monoisotopic Mass:
202.111g/mol
Topological Polar Surface Area:
32.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
298
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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