Name: 2-(pyrimidin-4-yl)benzoic acid hydrochloride
SMILES:
Cl.O=C(O)c1ccccc1-c1ccncn1Molecular Processing
Molecular formula
C11H9ClN2O2
Molecular weight
236.66
Exact mass
236.0353
XLogP
2.26
TPSA
63.08
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0
Molar refractivity
61.68
Supplementary Information
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Involved in 10 reactions→