名称: 1-(4'-carboxyphenyl)-3-phenyl-trans-1-butene
SMILES:
CC(/C=C/c1ccc(C(=O)O)cc1)c1ccccc1Molecular Processing
Molecular formula
C17H16O2
Molecular weight
252.31
Exact mass
252.115
XLogP
4.2
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
77.29
Supplementary Information
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