CAS: 4344-87-0
이름: 5-methyl-1,2-dihydropyrazol-3-one
SMILES:
CC1=CC(=O)NN1Molecular Processing
Molecular formula
C4H6N2O
Molecular weight
98.11
Exact mass
98.048
XLogP
0.01
TPSA
48.65
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
26.15
Supplementary Information
InChIKey: WGVHNCAJPFIFCR-UHFFFAOYSA-N
동의어
3-Methyl-3-pyrazolin-5-one5-methyl-2,3-dihydro-1H-pyrazol-3-oneRefChem:503791629-366-5954-339-23-methyl-1H-pyrazol-5-ol4344-87-05-Methyl-1H-pyrazol-3-ol132712-71-1145091-87-85-Methyl-1H-pyrazol-3(2H)-one3-Methyl-5-hydroxypyrazole5-methyl-1,2-dihydropyrazol-3-one3H-Pyrazol-3-one, 1,2-dihydro-5-methyl-MFCD004621881H-pyrazol-5-ol, 3-methyl-1H-Pyrazol-3-ol, 5-methyl- (9CI)5-Methyl-1,2-dihydro-3H-pyrazol-3-one3-methyl-3-pyrazoline-5-one3-Pyrazolin-5-one, 3-methyl-NSC2653353-methylpyrazol-5-ol5-Methylpyrazol-3-olhydroxy-5-methylpyrazole3-Pyrazolol, 5-methyl-3-methyl-pyrazolin-5-one3-hydroxy-5-methylpyrazoleSCHEMBL89522SCHEMBL456115SCHEMBL509878
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