이름: 4-(Morpholinocarbonyl)benzoic acid
SMILES:
O=C(O)c1ccc(C(=O)N2CCOCC2)cc1Molecular Processing
Molecular formula
C12H13NO4
Molecular weight
235.24
Exact mass
235.0845
XLogP
0.86
TPSA
66.84
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
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
0.333
Molar refractivity
60.12
Supplementary Information
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