SMILES:
OCC#CCOC1CCCCO1Molecular Processing
Molecular formula
C9H14O3
Molecular weight
170.21
Exact mass
170.0943
XLogP
0.53
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
44.4
Supplementary Information
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Involved in 20 reactions→