SMILES:
O=C1OCC(c2ccccc2)O1Molecular Processing
Molecular formula
C9H8O3
Molecular weight
164.16
Exact mass
164.0473
XLogP
1.89
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
41.62
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→