SMILES:
CCCCCCCCC#Cc1ccc(Br)cc1Molecular Processing
Molecular formula
C16H21Br
Molecular weight
293.25
Exact mass
292.0827
XLogP
5.55
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
6
Heavy atoms
17
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
0.5
Molar refractivity
79.01
Supplementary Information
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