Name: 2-phenyl-3-sulfonlyphenyl-propenoic acid, methyl ester
SMILES:
C=C(C(=O)OC)C1=CC=CC(=S(=O)=O)C1c1ccccc1Molecular Processing
Molecular formula
C16H14O4S
Molecular weight
302.35
Exact mass
302.0613
XLogP
2.05
TPSA
60.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
81.49
Supplementary Information
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Involved in 2 reactions→