CC1=CC=NN1
CAS: 1453-58-3
Nombre: 5-methyl-1H-pyrazole
SMILES: CC1=CC=NN1

Molecular Processing

Molecular formula
C4H6N2
Molecular weight
82.11
Exact mass
82.0531
XLogP
0.72
TPSA
28.68
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
6
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
23.32

Supplementary Information

InChIKey: XKVUYEYANWFIJX-UHFFFAOYSA-N
Sinónimos
3-Methylpyrazole1453-58-31H-Pyrazole, 3-methyl-3(5)-MethylpyrazoleW7KU1RRO6UDTXSID3073260RefChem:504324DTXCID0034726215-925-75-methyl-1H-pyrazole3-Methyl-1H-pyrazole88054-14-21H-Pyrazole,5-methyl-5-Methylpyrazole1H-Pyrazole, 5-methyl-Pyrazole, 5-methyl-PYRAZOLE, 3-METHYL-MFCD00005240methylpyrazoleMFCD08685900CHEMBL3275944EINECS 215-925-7UNII-W7KU1RRO6UBRN 00014543-methyl-pyrazole3-Methyl pyrazole3-methyl-1-H-pyrazole3-Methyl-1,2-diazole3-Methylpyrazole, 97%pyrazole, 3(5)-methyl-
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