3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene

C7H7F7 — CID 164994661

IUPAC3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene
SMILESC=CC(F)(C(F)C(C)(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-3-6(11,7(12,13)14)4(8)5(2,9)10/h3-4H,1H2,2H3
InChIKeyRVCXJRICLFNNOV-UHFFFAOYSA-N
MW224.12 g/mol
LogP3.44
Rot. Bonds3

About 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene

3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene (PubChem CID 164994661) has the molecular formula C7H7F7 and a molecular weight of 224.12 g/mol. Its IUPAC name is 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene.

Molecular Properties

Compound Name3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene
PubChem CID164994661
Molecular FormulaC7H7F7
Molecular Weight224.12 g/mol
Exact Mass224.04
IUPAC Name3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene
SMILESC=CC(F)(C(F)C(C)(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-3-6(11,7(12,13)14)4(8)5(2,9)10/h3-4H,1H2,2H3
InChIKeyRVCXJRICLFNNOV-UHFFFAOYSA-N
XLogP3.44
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 ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 141339436
3,4-difluoro-3-methylpent-1-ene
CID 123355021
ethene;1,1,1-trifluoroethane
CID 175131333
3,3-difluorobut-1-ene;propane
CID 143721745
3,3,3-trifluoroprop-1-ene
CID 90915807
4,4-difluoro-2,2-dimethylhex-5-en-3-ol
CID 12591139
1-[1,2-difluoro-2-(trifluoromethyl)but-3-enyl]-2-fluoro-2-(trifluoromethyl)piperidine
CID 162620220
3,3,4,4,5-pentamethylhex-1-ene
CID 23384855
1,1,1,2,3,4,5,5,5-nonafluoro-2-methyl-4-(trifluoromethyl)pentane
CID 54544362
3,3-difluoro-4,4-dimethylhex-5-en-2-one
CID 11084183
4,4-difluoropent-1-en-3-ylhydrazine
CID 130657320
3,3,4,4,5,5,6,6,7,7,8,8,9,9-tetradecamethylundeca-1,10-diene
CID 162304109

Frequently Asked Questions

What is the IUPAC name of 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene?
The IUPAC name of 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene (CID 164994661) is 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene.
What is the SMILES notation for 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene?
The canonical SMILES for 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene is C=CC(F)(C(F)C(C)(F)F)C(F)(F)F.
What is the InChIKey of 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene?
The InChIKey is RVCXJRICLFNNOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F7/c1-3-6(11,7(12,13)14)4(8)5(2,9)10/h3-4H,1H2,2H3.
What are the key properties of 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene?
3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene has a molecular weight of 224.12 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,5-tetrafluoro-3-(trifluoromethyl)hex-1-ene is sourced from PubChem (CID 164994661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).