名称: 4-chloro-5-cyclopropyl-2H-pyrazole-3-carboxylic acid
SMILES:
O=C(O)c1[nH]nc(C2CC2)c1ClMolecular Processing
Molecular formula
C7H7ClN2O2
Molecular weight
186.6
Exact mass
186.0196
XLogP
1.64
TPSA
65.98
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
42.53
Supplementary Information
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