Name: 2-methyl-2-neopentyl-3-hydroxypropionic acid
SMILES:
CC(C)(C)CC(C)(CO)C(=O)OMolecular Processing
Molecular formula
C9H18O3
Molecular weight
174.24
Exact mass
174.1256
XLogP
1.51
TPSA
57.53
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
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
0.889
Molar refractivity
46.9
Supplementary Information
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