Name: 2-biphenyl-4-ylmethyl-succinic acid 4-tert-butyl ester
SMILES:
CC(C)(C)OC(=O)CC(Cc1ccc(-c2ccccc2)cc1)C(=O)OMolecular Processing
Molecular formula
C21H24O4
Molecular weight
340.42
Exact mass
340.1675
XLogP
4.33
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
97.17
Supplementary Information
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