SMILES:
O=C(CCCCCCCBr)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C14H18BrClO
Molecular weight
317.65
Exact mass
316.023
XLogP
5.26
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
8
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
77.28
Supplementary Information
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