Nombre: 2-(2-Methoxy-5-bromophenyl)-2-methyl-1-chloropropane
SMILES:
COc1ccc(Br)cc1C(C)(C)CClMolecular Processing
Molecular formula
C11H14BrClO
Molecular weight
277.59
Exact mass
275.9917
XLogP
3.97
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
14
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
0.455
Molar refractivity
64.44
Supplementary Information
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