Название: arecoline HBr
SMILES:
Br.COC(=O)C1=CCCN(C)C1Molecular Processing
Molecular formula
C8H14BrNO2
Molecular weight
236.11
Exact mass
235.0208
XLogP
1
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.625
Molar refractivity
52.54
Supplementary Information
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