1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene

C8H9F7 — CID 23264460

IUPAC1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene
SMILESCCCCC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C8H9F7/c1-2-3-4-7(11,12)5(6(9)10)8(13,14)15/h2-4H2,1H3
InChIKeyQACJFZXPHMVQTI-UHFFFAOYSA-N
MW238.15 g/mol
LogP4.52
Rot. Bonds4

About 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene

1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene (PubChem CID 23264460) has the molecular formula C8H9F7 and a molecular weight of 238.15 g/mol. Its IUPAC name is 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene.

Molecular Properties

Compound Name1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene
PubChem CID23264460
Molecular FormulaC8H9F7
Molecular Weight238.15 g/mol
Exact Mass238.06
IUPAC Name1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene
SMILESCCCCC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C8H9F7/c1-2-3-4-7(11,12)5(6(9)10)8(13,14)15/h2-4H2,1H3
InChIKeyQACJFZXPHMVQTI-UHFFFAOYSA-N
XLogP4.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.15
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 2760788
3-Ethyl-1,1-difluoronona-1,2-diene
CID 12161213
2-Methyl-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-1-undecene
CID 12045643
Cyclohexane, 1,4-bis(difluoromethylene)-
CID 12965536
Hexofluoropropylene
CID 129703938
Octofluoro-Isobuten
CID 129761556
1,1,1,2,3,3-Hexafluoro-5-methylhexene-5
CID 12562976
1,1,2,8,9,9-Hexafluoro-1,8-nonadiene
CID 85809273
5,5,6,6,7,7,8,8,9,9,10,10,10-Tridecafluoro-2-methyldeca-2,3-diene
CID 139264106
5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Heptadecafluoro-2-methyldodeca-2,3-diene
CID 139264108
1,1,1-Trifluoro-4-methyleneoctane
CID 146018304
9,9,10,10,11,11,12,12,13,13,14,14,14-Tridecafluorotetradeca-6,7-diene
CID 162397468

Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene?
The IUPAC name of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene (CID 23264460) is 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene.
What is the SMILES notation for 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene?
The canonical SMILES for 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene is CCCCC(F)(F)C(=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene?
The InChIKey is QACJFZXPHMVQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F7/c1-2-3-4-7(11,12)5(6(9)10)8(13,14)15/h2-4H2,1H3.
What are the key properties of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene?
1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene has a molecular weight of 238.15 g/mol, XLogP of 4.52, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hept-1-ene is sourced from PubChem (CID 23264460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).