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C8H10O3 | Cheminformatics
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(3Z)-3-(oxolan-3-ylidene)oxolan-2-one

Molecular Formula : C8H10O3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
(3Z)-3-(oxolan-3-ylidene)oxolan-2-one is a drug-like molecule.

MolName : (3Z)-3-(oxolan-3-ylidene)oxolan-2-one

MolecularFormula : C8H10O3

Smiles : O=C1OCC/C1=C1/COCC1

InChI : InChI=1S/C8H10O3/c9-8-7(2-4-11-8)6-1-3-10-5-6/h1-5H2

InChIK : YHKVAQGJEMAZMW-UHFFFAOYSA-N

TotalMolweight : 154.164

Molweight : 154.164

MonoisotopicMass : 154.062995

CLogP : 0.1536

CLogS : -1

H Acceptors : 3

TotalSurfaceArea : 115.97

Relative PSA : 0.2849

PolarSurfaceArea : 35.53

Druglikeness : -1.4207

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions :

Shape Index : 0.54545

Fragments : 1

Non HAtoms : 11

NonCHAtoms : 3

Electronegative Atoms : 3

Rings Closures : 2

Small Rings : 2

Sp3Atoms : 7

StereoCon :

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