1-[(4Z)-4-ethylidenefuran-2-yl]ethanone

C8H10O2 — CID 126611341

IUPAC1-[(4Z)-4-ethylidenefuran-2-yl]ethanone
SMILESC/C=C1/C=C(C(C)=O)OC1
InChIInChI=1S/C8H10O2/c1-3-7-4-8(6(2)9)10-5-7/h3-4H,5H2,1-2H3/b7-3-
InChIKeyMSVCMQQPPKOCCV-CLTKARDFSA-N
MW138.17 g/mol
LogP1.44
Rot. Bonds1

About 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone

1-[(4Z)-4-ethylidenefuran-2-yl]ethanone (PubChem CID 126611341) has the molecular formula C8H10O2 and a molecular weight of 138.17 g/mol. Its IUPAC name is 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone.

Molecular Properties

Compound Name1-[(4Z)-4-ethylidenefuran-2-yl]ethanone
PubChem CID126611341
Molecular FormulaC8H10O2
Molecular Weight138.17 g/mol
Exact Mass138.07
IUPAC Name1-[(4Z)-4-ethylidenefuran-2-yl]ethanone
SMILESC/C=C1/C=C(C(C)=O)OC1
InChIInChI=1S/C8H10O2/c1-3-7-4-8(6(2)9)10-5-7/h3-4H,5H2,1-2H3/b7-3-
InChIKeyMSVCMQQPPKOCCV-CLTKARDFSA-N
XLogP1.44
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone?
The IUPAC name of 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone (CID 126611341) is 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone.
What is the SMILES notation for 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone?
The canonical SMILES for 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone is C/C=C1/C=C(C(C)=O)OC1.
What is the InChIKey of 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone?
The InChIKey is MSVCMQQPPKOCCV-CLTKARDFSA-N. The full InChI is InChI=1S/C8H10O2/c1-3-7-4-8(6(2)9)10-5-7/h3-4H,5H2,1-2H3/b7-3-.
What are the key properties of 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone?
1-[(4Z)-4-ethylidenefuran-2-yl]ethanone has a molecular weight of 138.17 g/mol, XLogP of 1.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4Z)-4-ethylidenefuran-2-yl]ethanone is sourced from PubChem (CID 126611341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).