Name: 1-Acetyl-3-(2-bromoethyl)-4,6-dimethylindoline
SMILES:
CC(=O)N1CC(CCBr)c2c(C)cc(C)cc21Molecular Processing
Molecular formula
C14H18BrNO
Molecular weight
296.21
Exact mass
295.0572
XLogP
3.54
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
75.1
Supplementary Information
Details werden geladen…
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