SMILES:
BrCCCC=Cc1ccccc1Molecular Processing
Molecular formula
C11H13Br
Molecular weight
225.13
Exact mass
224.0201
XLogP
3.87
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
4
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
58.5
Supplementary Information
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