(Z,3Z)-3-ethylidene-1-fluorohex-1-ene

C8H13F — CID 89269621

IUPAC(Z,3Z)-3-ethylidene-1-fluorohex-1-ene
SMILESC/C=C(\C=C/F)CCC
InChIInChI=1S/C8H13F/c1-3-5-8(4-2)6-7-9/h4,6-7H,3,5H2,1-2H3/b7-6-,8-4-
InChIKeyRJWFUPVIBHYWDL-BGTGQFSUSA-N
MW128.19 g/mol
LogP3.22
Rot. Bonds3

About (Z,3Z)-3-ethylidene-1-fluorohex-1-ene

(Z,3Z)-3-ethylidene-1-fluorohex-1-ene (PubChem CID 89269621) has the molecular formula C8H13F and a molecular weight of 128.19 g/mol. Its IUPAC name is (Z,3Z)-3-ethylidene-1-fluorohex-1-ene.

Molecular Properties

Compound Name(Z,3Z)-3-ethylidene-1-fluorohex-1-ene
PubChem CID89269621
Molecular FormulaC8H13F
Molecular Weight128.19 g/mol
Exact Mass128.10
IUPAC Name(Z,3Z)-3-ethylidene-1-fluorohex-1-ene
SMILESC/C=C(\C=C/F)CCC
InChIInChI=1S/C8H13F/c1-3-5-8(4-2)6-7-9/h4,6-7H,3,5H2,1-2H3/b7-6-,8-4-
InChIKeyRJWFUPVIBHYWDL-BGTGQFSUSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.19
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (Z,3Z)-3-ethylidene-1-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 (Z,3Z)-3-ethylidene-1-fluorohex-1-ene?
The IUPAC name of (Z,3Z)-3-ethylidene-1-fluorohex-1-ene (CID 89269621) is (Z,3Z)-3-ethylidene-1-fluorohex-1-ene.
What is the SMILES notation for (Z,3Z)-3-ethylidene-1-fluorohex-1-ene?
The canonical SMILES for (Z,3Z)-3-ethylidene-1-fluorohex-1-ene is C/C=C(\C=C/F)CCC.
What is the InChIKey of (Z,3Z)-3-ethylidene-1-fluorohex-1-ene?
The InChIKey is RJWFUPVIBHYWDL-BGTGQFSUSA-N. The full InChI is InChI=1S/C8H13F/c1-3-5-8(4-2)6-7-9/h4,6-7H,3,5H2,1-2H3/b7-6-,8-4-.
What are the key properties of (Z,3Z)-3-ethylidene-1-fluorohex-1-ene?
(Z,3Z)-3-ethylidene-1-fluorohex-1-ene has a molecular weight of 128.19 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,3Z)-3-ethylidene-1-fluorohex-1-ene is sourced from PubChem (CID 89269621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).