Name: isocrotonic acid diphenylmethyl ester
SMILES:
C/C=C\C(=O)OC(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C17H16O2
Molecular weight
252.31
Exact mass
252.115
XLogP
3.9
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
75.63
Supplementary Information
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