Nombre: (R)-(+)-3,7-dimethyloctanoic acid
SMILES:
CC(C)CCC[C@@H](C)CC(=O)OMolecular Processing
Molecular formula
C10H20O2
Molecular weight
172.27
Exact mass
172.1463
XLogP
2.92
TPSA
37.3
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
50.11
Supplementary Information
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