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

C7H7F7 — CID 19788876

IUPAC1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene
SMILESCCCC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-2-3-6(10,11)4(5(8)9)7(12,13)14/h2-3H2,1H3
InChIKeyFMWXLSJLMNILAX-UHFFFAOYSA-N
MW224.12 g/mol
LogP4.13
Rot. Bonds3

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

1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene (PubChem CID 19788876) has the molecular formula C7H7F7 and a molecular weight of 224.12 g/mol. Its IUPAC name is 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene.

Molecular Properties

Compound Name1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene
PubChem CID19788876
Molecular FormulaC7H7F7
Molecular Weight224.12 g/mol
Exact Mass224.04
IUPAC Name1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene
SMILESCCCC(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-2-3-6(10,11)4(5(8)9)7(12,13)14/h2-3H2,1H3
InChIKeyFMWXLSJLMNILAX-UHFFFAOYSA-N
XLogP4.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.12
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene?
The IUPAC name of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene (CID 19788876) is 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene.
What is the SMILES notation for 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene?
The canonical SMILES for 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene is CCCC(F)(F)C(=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene?
The InChIKey is FMWXLSJLMNILAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F7/c1-2-3-6(10,11)4(5(8)9)7(12,13)14/h2-3H2,1H3.
What are the key properties of 1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene?
1,1,3,3-tetrafluoro-2-(trifluoromethyl)hex-1-ene has a molecular weight of 224.12 g/mol, XLogP of 4.13, 3 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)hex-1-ene is sourced from PubChem (CID 19788876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).