COC1(CCOCC1)C#CCOC2CCCCO2
Nom: 4-methoxy-4-[3-(oxan-2-yloxy)prop-1-ynyl]oxane
SMILES: COC1(CCOCC1)C#CCOC2CCCCO2

Molecular Processing

Molecular formula
C14H22O4
Molecular weight
254.33
Exact mass
254.1518
XLogP
1.73
TPSA
36.92
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
67.11

Supplementary Information

InChIKey: ANWJBOLAWHEWKU-UHFFFAOYSA-N
Synonymes
SCHEMBL9135177ANWJBOLAWHEWKU-UHFFFAOYSA-N4-methoxy-4-[3-(tetrahydropyran-2-yloxy)prop-1-ynyl]tetrahydropyran4-methoxy-4-[3-(tetrahydropyran-2-yloxy)-prop-1-ynyl]tetrahydropyran
Voir la source →
Impliqué dans 6 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→