Name: 5-Hydroxy-2H-pyrazole-3-carboxylic acid ethyl ester
SMILES:
CCOC(=O)c1cc(O)n[nH]1Molecular Processing
Molecular formula
C6H8N2O3
Molecular weight
156.14
Exact mass
156.0535
XLogP
0.29
TPSA
75.21
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
36.21
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→