(2E,4E)-3,5-difluorohepta-2,4-diene

C7H10F2 — CID 142421363

IUPAC(2E,4E)-3,5-difluorohepta-2,4-diene
SMILESC/C=C(F)\C=C(\F)CC
InChIInChI=1S/C7H10F2/c1-3-6(8)5-7(9)4-2/h3,5H,4H2,1-2H3/b6-3+,7-5+
InChIKeyUVTJGLSUPAHUTC-SNCPXTGUSA-N
MW132.15 g/mol
LogP3.12
Rot. Bonds2

About (2E,4E)-3,5-difluorohepta-2,4-diene

(2E,4E)-3,5-difluorohepta-2,4-diene (PubChem CID 142421363) has the molecular formula C7H10F2 and a molecular weight of 132.15 g/mol. Its IUPAC name is (2E,4E)-3,5-difluorohepta-2,4-diene.

Molecular Properties

Compound Name(2E,4E)-3,5-difluorohepta-2,4-diene
PubChem CID142421363
Molecular FormulaC7H10F2
Molecular Weight132.15 g/mol
Exact Mass132.08
IUPAC Name(2E,4E)-3,5-difluorohepta-2,4-diene
SMILESC/C=C(F)\C=C(\F)CC
InChIInChI=1S/C7H10F2/c1-3-6(8)5-7(9)4-2/h3,5H,4H2,1-2H3/b6-3+,7-5+
InChIKeyUVTJGLSUPAHUTC-SNCPXTGUSA-N
XLogP3.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.15
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (2E,4E)-3,5-difluorohepta-2,4-diene 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 (2E,4E)-3,5-difluorohepta-2,4-diene?
The IUPAC name of (2E,4E)-3,5-difluorohepta-2,4-diene (CID 142421363) is (2E,4E)-3,5-difluorohepta-2,4-diene.
What is the SMILES notation for (2E,4E)-3,5-difluorohepta-2,4-diene?
The canonical SMILES for (2E,4E)-3,5-difluorohepta-2,4-diene is C/C=C(F)\C=C(\F)CC.
What is the InChIKey of (2E,4E)-3,5-difluorohepta-2,4-diene?
The InChIKey is UVTJGLSUPAHUTC-SNCPXTGUSA-N. The full InChI is InChI=1S/C7H10F2/c1-3-6(8)5-7(9)4-2/h3,5H,4H2,1-2H3/b6-3+,7-5+.
What are the key properties of (2E,4E)-3,5-difluorohepta-2,4-diene?
(2E,4E)-3,5-difluorohepta-2,4-diene has a molecular weight of 132.15 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-3,5-difluorohepta-2,4-diene is sourced from PubChem (CID 142421363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).