(5Z)-4-ethoxy-5-ethylidenefuran-2-one

C8H10O3 — CID 10606975

IUPAC(5Z)-4-ethoxy-5-ethylidenefuran-2-one
SMILESC/C=C1\OC(=O)C=C1OCC
InChIInChI=1S/C8H10O3/c1-3-6-7(10-4-2)5-8(9)11-6/h3,5H,4H2,1-2H3/b6-3-
InChIKeySUDIUPJZTJLJRO-UTCJRWHESA-N
MW154.16 g/mol
LogP1.37
Rot. Bonds2

About (5Z)-4-ethoxy-5-ethylidenefuran-2-one

(5Z)-4-ethoxy-5-ethylidenefuran-2-one (PubChem CID 10606975) has the molecular formula C8H10O3 and a molecular weight of 154.16 g/mol. Its IUPAC name is (5Z)-4-ethoxy-5-ethylidenefuran-2-one.

Molecular Properties

Compound Name(5Z)-4-ethoxy-5-ethylidenefuran-2-one
PubChem CID10606975
Molecular FormulaC8H10O3
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name(5Z)-4-ethoxy-5-ethylidenefuran-2-one
SMILESC/C=C1\OC(=O)C=C1OCC
InChIInChI=1S/C8H10O3/c1-3-6-7(10-4-2)5-8(9)11-6/h3,5H,4H2,1-2H3/b6-3-
InChIKeySUDIUPJZTJLJRO-UTCJRWHESA-N
XLogP1.37
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5Z)-4-ethoxy-5-ethylidenefuran-2-one?
The IUPAC name of (5Z)-4-ethoxy-5-ethylidenefuran-2-one (CID 10606975) is (5Z)-4-ethoxy-5-ethylidenefuran-2-one.
What is the SMILES notation for (5Z)-4-ethoxy-5-ethylidenefuran-2-one?
The canonical SMILES for (5Z)-4-ethoxy-5-ethylidenefuran-2-one is C/C=C1\OC(=O)C=C1OCC.
What is the InChIKey of (5Z)-4-ethoxy-5-ethylidenefuran-2-one?
The InChIKey is SUDIUPJZTJLJRO-UTCJRWHESA-N. The full InChI is InChI=1S/C8H10O3/c1-3-6-7(10-4-2)5-8(9)11-6/h3,5H,4H2,1-2H3/b6-3-.
What are the key properties of (5Z)-4-ethoxy-5-ethylidenefuran-2-one?
(5Z)-4-ethoxy-5-ethylidenefuran-2-one has a molecular weight of 154.16 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4-ethoxy-5-ethylidenefuran-2-one is sourced from PubChem (CID 10606975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).