CCC(C)COCC(C)CC
SMILES: CCC(C)COCC(C)CC

Molecular Processing

Molecular formula
C10H22O
Molecular weight
158.28
Exact mass
158.1671
XLogP
3.1
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
49.73

Supplementary Information

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