Name: 4-bromo-3-methylbutanol
SMILES:
CC(CBr)CCOMolecular Processing
Molecular formula
C5H11BrO
Molecular weight
167.05
Exact mass
165.9993
XLogP
1.4
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
7
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
34.66
Supplementary Information
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