SMILES:
CCCCCCC(Br)C(=O)OCCMolecular Processing
Molecular formula
C10H19BrO2
Molecular weight
251.16
Exact mass
250.0568
XLogP
3.28
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
13
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
58.11
Supplementary Information
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