O=C(OCc1ccccc1)c1cc(O)cc(O)c1
Name: 3,5-dihydroxybenzoic acid phenylmethyl ester
SMILES: O=C(OCc1ccccc1)c1cc(O)cc(O)c1

Molecular Processing

Molecular formula
C14H12O4
Molecular weight
244.25
Exact mass
244.0736
XLogP
2.45
TPSA
66.76
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
65.33

Supplementary Information

Details werden geladen…

An 4 Reaktionen beteiligt