SMILES:
COC(=O)CC1C=CC=C1Molecular Processing
Molecular formula
C8H10O2
Molecular weight
138.17
Exact mass
138.0681
XLogP
1.29
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
38.4
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→