C#CC1CCC2(CC1)OCCO2
CAS: 96184-86-0
Name: 8-ethynyl-1,4-dioxaspiro[4.5]decane
SMILES: C#CC1CCC2(CC1)OCCO2

Molecular Processing

Molecular formula
C10H14O2
Molecular weight
166.22
Exact mass
166.0994
XLogP
1.55
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
45.43

Supplementary Information

InChIKey: KLQRERRXSGHFPC-UHFFFAOYSA-N
Synonyme
8-ethynyl-1,4-dioxaspiro[4.5]decane96184-86-0MFCD259729274-ethynyl-1,1-ethylenedioxycyclohexaneSCHEMBL3693272KLQRERRXSGHFPC-UHFFFAOYSA-NAKOS026716035PB43985BS-43127SY279149DB-170564CS-0312333EN300-320811P19187F720499F2147-2818
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