SMILES:
CC1(C)COCCN1Molecular Processing
Molecular formula
C6H13NO
Molecular weight
115.18
Exact mass
115.0997
XLogP
0.38
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
32.9
Supplementary Information
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