SMILES:
CCOC(=O)CC1OCCc2c(Br)cccc21Molecular Processing
Molecular formula
C13H15BrO3
Molecular weight
299.16
Exact mass
298.0205
XLogP
3.02
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
67.79
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→