الاسم: 6-(3,4-methylenedioxyphenyl)-3-hexenyl bromide
SMILES:
BrCCC=CCCc1ccc2c(c1)OCO2Molecular Processing
Molecular formula
C13H15BrO2
Molecular weight
283.17
Exact mass
282.0255
XLogP
3.69
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
68.44
Supplementary Information
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