Name: 2-bromo-3-methylbutyric acid
SMILES:
CC(C)C(Br)C(=O)OMolecular Processing
Molecular formula
C5H9BrO2
Molecular weight
181.03
Exact mass
179.9786
XLogP
1.49
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
35.19
Supplementary Information
Details werden geladen…
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