Nombre: 1-Bromo-7-(4-chlorophenoxy)heptane
SMILES:
Clc1ccc(OCCCCCCCBr)cc1Molecular Processing
Molecular formula
C13H18BrClO
Molecular weight
305.64
Exact mass
304.023
XLogP
5.06
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
8
Heavy atoms
16
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
0.538
Molar refractivity
73.83
Supplementary Information
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