Name: 4-chloro-5-propyl-1H-imidazole-2-carboxylic acid
SMILES:
CCCc1[nH]c(C(=O)O)nc1ClMolecular Processing
Molecular formula
C7H9ClN2O2
Molecular weight
188.61
Exact mass
188.0353
XLogP
1.71
TPSA
65.98
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
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
0.429
Molar refractivity
44.55
Supplementary Information
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