Nombre: 6-Bromo-7-methoxy-1,1-dimethyl-3,4-dihydro-1H-naphthalen-2-one
SMILES:
COc1cc2c(cc1Br)CCC(=O)C2(C)CMolecular Processing
Molecular formula
C13H15BrO2
Molecular weight
283.16
Exact mass
282.0255
XLogP
3.25
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
67.05
Supplementary Information
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