SMILES:
O=C(CBr)C1CC2CCCCC2C1Molecular Processing
Molecular formula
C11H17BrO
Molecular weight
245.16
Exact mass
244.0463
XLogP
3.17
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
56.97
Supplementary Information
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