الاسم: 1-(4-hydroxy-1-methyl-1H-pyrazol-3-yl)ethanone
SMILES:
CC(=O)c1nn(C)cc1OMolecular Processing
Molecular formula
C6H8N2O2
Molecular weight
140.14
Exact mass
140.0586
XLogP
0.33
TPSA
55.12
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
34.88
Supplementary Information
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