SMILES:
CC1(Br)CCCCC1=OMolecular Processing
Molecular formula
C7H11BrO
Molecular weight
191.07
Exact mass
189.9993
XLogP
2.28
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
40.81
Supplementary Information
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