C1CCOC(C1)OC2CC(=O)C=C2
CAS: 62356-78-9
Название: 4-(oxan-2-yloxy)cyclopent-2-en-1-one
SMILES: C1CCOC(C1)OC2CC(=O)C=C2

Molecular Processing

Molecular formula
C10H14O3
Molecular weight
182.22
Exact mass
182.0943
XLogP
1.43
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
47.23

Supplementary Information

InChIKey: KNDDEJNSZWCUJL-UHFFFAOYSA-N
Синонимы
62356-78-92-Cyclopenten-1-one, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-4-(tetrahydro-pyran-2-yloxy)-cyclopent-2-enoneSCHEMBL8577763DTXSID40511140KNDDEJNSZWCUJL-UHFFFAOYSA-N4-[(Oxan-2-yl)oxy]cyclopent-2-en-1-one4-(2-tetrahydropyranyl)oxy-2-cyclopentenone4-(2-tetrahydropyranyloxy)cyclopent-2-en-1-one4-((Tetrahydro-2H-pyran-2-yl)oxy)cyclopent-2-en-1-one
Источник
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