SMILES:
CNCC(O)C1COC(C)(C)O1Molecular Processing
Molecular formula
C8H17NO3
Molecular weight
175.23
Exact mass
175.1208
XLogP
-0.28
TPSA
50.72
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
1
Molar refractivity
44.84
Supplementary Information
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