CC1(C)OCc2cc([C@@H](O)CBr)ccc2O1
Nombre: (1R)-2-Bromo-1-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)ethanol
SMILES: CC1(C)OCc2cc([C@@H](O)CBr)ccc2O1

Molecular Processing

Molecular formula
C12H15BrO3
Molecular weight
287.15
Exact mass
286.0205
XLogP
2.76
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
64.69

Supplementary Information

Obteniendo detalles…

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