名称: 6-chloro-2-p-tolylbenzoxazole-4-carboxylic acid
SMILES:
Cc1ccc(-c2nc3c(C(=O)O)cc(Cl)cc3o2)cc1Molecular Processing
Molecular formula
C15H10ClNO3
Molecular weight
287.7
Exact mass
287.0349
XLogP
4.15
TPSA
63.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
76.15
Supplementary Information
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