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

C7H10F2 — CID 88932159

IUPAC(2E,4E)-2,4-difluorohepta-2,4-diene
SMILESCC/C=C(F)\C=C(/C)F
InChIInChI=1S/C7H10F2/c1-3-4-7(9)5-6(2)8/h4-5H,3H2,1-2H3/b6-5+,7-4+
InChIKeyUQHKHIBZBHLZMQ-HVUXDCMCSA-N
MW132.15 g/mol
LogP3.12
Rot. Bonds2

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

(2E,4E)-2,4-difluorohepta-2,4-diene (PubChem CID 88932159) has the molecular formula C7H10F2 and a molecular weight of 132.15 g/mol. Its IUPAC name is (2E,4E)-2,4-difluorohepta-2,4-diene.

Molecular Properties

Compound Name(2E,4E)-2,4-difluorohepta-2,4-diene
PubChem CID88932159
Molecular FormulaC7H10F2
Molecular Weight132.15 g/mol
Exact Mass132.08
IUPAC Name(2E,4E)-2,4-difluorohepta-2,4-diene
SMILESCC/C=C(F)\C=C(/C)F
InChIInChI=1S/C7H10F2/c1-3-4-7(9)5-6(2)8/h4-5H,3H2,1-2H3/b6-5+,7-4+
InChIKeyUQHKHIBZBHLZMQ-HVUXDCMCSA-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'}

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Related Compounds

CID 12756891
CID 12756891
CID 90166011
CID 90166011
CID 129760108
CID 129760108
CID 15209488
CID 15209488
CID 12757176
CID 12757176
CID 21723812
CID 21723812
CID 12756890
CID 12756890
CID 12757175
CID 12757175
CID 13165649
CID 13165649
CID 13165650
CID 13165650
CID 18520950
CID 18520950
CID 20065290
CID 20065290

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-2,4-difluorohepta-2,4-diene?
The IUPAC name of (2E,4E)-2,4-difluorohepta-2,4-diene (CID 88932159) is (2E,4E)-2,4-difluorohepta-2,4-diene.
What is the SMILES notation for (2E,4E)-2,4-difluorohepta-2,4-diene?
The canonical SMILES for (2E,4E)-2,4-difluorohepta-2,4-diene is CC/C=C(F)\C=C(/C)F.
What is the InChIKey of (2E,4E)-2,4-difluorohepta-2,4-diene?
The InChIKey is UQHKHIBZBHLZMQ-HVUXDCMCSA-N. The full InChI is InChI=1S/C7H10F2/c1-3-4-7(9)5-6(2)8/h4-5H,3H2,1-2H3/b6-5+,7-4+.
What are the key properties of (2E,4E)-2,4-difluorohepta-2,4-diene?
(2E,4E)-2,4-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)-2,4-difluorohepta-2,4-diene is sourced from PubChem (CID 88932159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).