Name: 3-bromo-1-(hydroxymethyl)-naphthalene
SMILES:
OCc1cc(Br)cc2ccccc12Molecular Processing
Molecular formula
C11H9BrO
Molecular weight
237.1
Exact mass
235.9837
XLogP
3.09
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
57.57
Supplementary Information
Details werden geladen…
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