COCOc1ccc(Br)cc1CO
Name: 5-bromo-2-methoxymethoxybenzyl alcohol
SMILES: COCOc1ccc(Br)cc1CO

Molecular Processing

Molecular formula
C9H11BrO3
Molecular weight
247.09
Exact mass
245.9892
XLogP
1.92
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
52.57

Supplementary Information

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