1,1,2,8-tetrafluorooct-4-ene

C8H12F4 — CID 174613396

IUPAC1,1,2,8-tetrafluorooct-4-ene
SMILESFCCCC=CCC(F)C(F)F
InChIInChI=1S/C8H12F4/c9-6-4-2-1-3-5-7(10)8(11)12/h1,3,7-8H,2,4-6H2
InChIKeyHMOMGNPFCRPMRC-UHFFFAOYSA-N
MW184.18 g/mol
LogP3.29
Rot. Bonds6

About 1,1,2,8-tetrafluorooct-4-ene

1,1,2,8-tetrafluorooct-4-ene (PubChem CID 174613396) has the molecular formula C8H12F4 and a molecular weight of 184.18 g/mol. Its IUPAC name is 1,1,2,8-tetrafluorooct-4-ene.

Molecular Properties

Compound Name1,1,2,8-tetrafluorooct-4-ene
PubChem CID174613396
Molecular FormulaC8H12F4
Molecular Weight184.18 g/mol
Exact Mass184.09
IUPAC Name1,1,2,8-tetrafluorooct-4-ene
SMILESFCCCC=CCC(F)C(F)F
InChIInChI=1S/C8H12F4/c9-6-4-2-1-3-5-7(10)8(11)12/h1,3,7-8H,2,4-6H2
InChIKeyHMOMGNPFCRPMRC-UHFFFAOYSA-N
XLogP3.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.18
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-5-fluoropent-1-ene
CID 54369984
(Z)-14-fluorotetradec-3-en-1-ol
CID 86739508
8,8-difluorooct-3-en-1-amine
CID 90786010
2-amino-12-fluoro-3,4-dihydroxydodec-6-enoic acid
CID 91138935
(E)-7-bromo-1-fluorohept-3-ene
CID 155605858
1,14-difluorotetradec-1-ene
CID 173198154
1-chloro-9-fluoronon-1-ene
CID 175497704
6-fluoro-1-(6-fluorohex-1-enoxy)hex-1-ene
CID 91221242
(E)-dec-5-en-3-ol
CID 21493231
(5Z,8Z,11Z,14Z)-1-fluorohenicosa-5,8,11,14-tetraene
CID 159191741
chloro-[(E)-5-fluoropent-1-enoxy]-di(propan-2-yl)silane
CID 10444964
(E)-2-methyldec-4-ene
CID 5364887

Frequently Asked Questions

What is the IUPAC name of 1,1,2,8-tetrafluorooct-4-ene?
The IUPAC name of 1,1,2,8-tetrafluorooct-4-ene (CID 174613396) is 1,1,2,8-tetrafluorooct-4-ene.
What is the SMILES notation for 1,1,2,8-tetrafluorooct-4-ene?
The canonical SMILES for 1,1,2,8-tetrafluorooct-4-ene is FCCCC=CCC(F)C(F)F.
What is the InChIKey of 1,1,2,8-tetrafluorooct-4-ene?
The InChIKey is HMOMGNPFCRPMRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F4/c9-6-4-2-1-3-5-7(10)8(11)12/h1,3,7-8H,2,4-6H2.
What are the key properties of 1,1,2,8-tetrafluorooct-4-ene?
1,1,2,8-tetrafluorooct-4-ene has a molecular weight of 184.18 g/mol, XLogP of 3.29, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,8-tetrafluorooct-4-ene is sourced from PubChem (CID 174613396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).