名称: 1-(1-Methyl-2,2-diethoxyethyl)-4-carboxy-5-aminopyrazole
SMILES:
CCOC(OCC)C(C)n1ncc(C(=O)O)c1NMolecular Processing
Molecular formula
C11H19N3O4
Molecular weight
257.29
Exact mass
257.1376
XLogP
1.12
TPSA
99.6
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
65.35
Supplementary Information
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