3-fluorohex-1-ene

C6H11F — CID 23437622

IUPAC3-fluorohex-1-ene
SMILESC=CC(F)CCC
InChIInChI=1S/C6H11F/c1-3-5-6(7)4-2/h4,6H,2-3,5H2,1H3
InChIKeyJCSLEJBTMJWFBL-UHFFFAOYSA-N
MW102.15 g/mol
LogP2.31
Rot. Bonds3

About 3-fluorohex-1-ene

3-fluorohex-1-ene (PubChem CID 23437622) has the molecular formula C6H11F and a molecular weight of 102.15 g/mol. Its IUPAC name is 3-fluorohex-1-ene.

Molecular Properties

Compound Name3-fluorohex-1-ene
PubChem CID23437622
Molecular FormulaC6H11F
Molecular Weight102.15 g/mol
Exact Mass102.08
IUPAC Name3-fluorohex-1-ene
SMILESC=CC(F)CCC
InChIInChI=1S/C6H11F/c1-3-5-6(7)4-2/h4,6H,2-3,5H2,1H3
InChIKeyJCSLEJBTMJWFBL-UHFFFAOYSA-N
XLogP2.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.15
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 3-fluorohex-1-ene 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 3-fluorohex-1-ene?
The IUPAC name of 3-fluorohex-1-ene (CID 23437622) is 3-fluorohex-1-ene.
What is the SMILES notation for 3-fluorohex-1-ene?
The canonical SMILES for 3-fluorohex-1-ene is C=CC(F)CCC.
What is the InChIKey of 3-fluorohex-1-ene?
The InChIKey is JCSLEJBTMJWFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F/c1-3-5-6(7)4-2/h4,6H,2-3,5H2,1H3.
What are the key properties of 3-fluorohex-1-ene?
3-fluorohex-1-ene has a molecular weight of 102.15 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluorohex-1-ene is sourced from PubChem (CID 23437622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).