(3Z)-4-fluoro-3-propylideneoxane

C8H13FO — CID 134461992

IUPAC(3Z)-4-fluoro-3-propylideneoxane
SMILESCC/C=C1/COCCC1F
InChIInChI=1S/C8H13FO/c1-2-3-7-6-10-5-4-8(7)9/h3,8H,2,4-6H2,1H3/b7-3-
InChIKeyKYGSNZLFMJIQLP-CLTKARDFSA-N
MW144.19 g/mol
LogP2.08
Rot. Bonds1

About (3Z)-4-fluoro-3-propylideneoxane

(3Z)-4-fluoro-3-propylideneoxane (PubChem CID 134461992) has the molecular formula C8H13FO and a molecular weight of 144.19 g/mol. Its IUPAC name is (3Z)-4-fluoro-3-propylideneoxane.

Molecular Properties

Compound Name(3Z)-4-fluoro-3-propylideneoxane
PubChem CID134461992
Molecular FormulaC8H13FO
Molecular Weight144.19 g/mol
Exact Mass144.10
IUPAC Name(3Z)-4-fluoro-3-propylideneoxane
SMILESCC/C=C1/COCCC1F
InChIInChI=1S/C8H13FO/c1-2-3-7-6-10-5-4-8(7)9/h3,8H,2,4-6H2,1H3/b7-3-
InChIKeyKYGSNZLFMJIQLP-CLTKARDFSA-N
XLogP2.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (3Z)-4-fluoro-3-propylideneoxane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3Z)-4-fluoro-3-propylideneoxane?
The IUPAC name of (3Z)-4-fluoro-3-propylideneoxane (CID 134461992) is (3Z)-4-fluoro-3-propylideneoxane.
What is the SMILES notation for (3Z)-4-fluoro-3-propylideneoxane?
The canonical SMILES for (3Z)-4-fluoro-3-propylideneoxane is CC/C=C1/COCCC1F.
What is the InChIKey of (3Z)-4-fluoro-3-propylideneoxane?
The InChIKey is KYGSNZLFMJIQLP-CLTKARDFSA-N. The full InChI is InChI=1S/C8H13FO/c1-2-3-7-6-10-5-4-8(7)9/h3,8H,2,4-6H2,1H3/b7-3-.
What are the key properties of (3Z)-4-fluoro-3-propylideneoxane?
(3Z)-4-fluoro-3-propylideneoxane has a molecular weight of 144.19 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-4-fluoro-3-propylideneoxane is sourced from PubChem (CID 134461992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).