1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene

C8H6F10 — CID 59892543

IUPAC1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene
SMILESCC(C)(C(=C(F)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H6F10/c1-5(2,8(16,17)18)3(6(10,11)12)4(9)7(13,14)15/h1-2H3
InChIKeyQMLVEGZRNNYWCU-UHFFFAOYSA-N
MW292.12 g/mol
LogP4.92
Rot. Bonds1

About 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene

1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene (PubChem CID 59892543) has the molecular formula C8H6F10 and a molecular weight of 292.12 g/mol. Its IUPAC name is 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene.

Molecular Properties

Compound Name1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene
PubChem CID59892543
Molecular FormulaC8H6F10
Molecular Weight292.12 g/mol
Exact Mass292.03
IUPAC Name1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene
SMILESCC(C)(C(=C(F)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H6F10/c1-5(2,8(16,17)18)3(6(10,11)12)4(9)7(13,14)15/h1-2H3
InChIKeyQMLVEGZRNNYWCU-UHFFFAOYSA-N
XLogP4.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.12
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1,1,3,4,4-hexafluoro-2-(trifluoromethyl)pent-2-ene
CID 130330536
(E)-1,1,1,2,3,4-hexafluoro-4-methylpent-2-ene
CID 163535527
1,1,1,2,5,6,6,6-octafluoro-3,4-dimethylhexa-2,4-diene
CID 173395165
(E)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methylpent-2-ene;1,1,2-trifluoroprop-1-ene
CID 159475239
(3Z)-1,1,4,5,5,5-hexafluoro-3-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)-2-(trifluoromethyl)penta-1,3-diene
CID 11189008
1,1,2,3,4,4,4-heptafluoro-3-methylbut-1-ene
CID 18629941
ethane;(E)-1,1,1,2,4,4,4-heptafluoro-3-methylbut-2-ene
CID 142059111
2-[bromo(difluoro)methyl]-1,1,3,3,3-pentafluoroprop-1-ene
CID 564811
1,1,2,3,3,3-hexafluoroprop-1-ene hexafluoride
CID 158507294
1,1,2,3,3,3-hexafluoroprop-1-ene;dihydrobromide
CID 88822630
1,1,2,3,3,3-hexafluoroprop-1-ene;dihydrofluoride
CID 162622378
(Z)-1,1,1,2,3,4,5,5,5-nonafluoro-4-methoxypent-2-ene
CID 146451149

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene?
The IUPAC name of 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene (CID 59892543) is 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene.
What is the SMILES notation for 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene?
The canonical SMILES for 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene is CC(C)(C(=C(F)C(F)(F)F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene?
The InChIKey is QMLVEGZRNNYWCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F10/c1-5(2,8(16,17)18)3(6(10,11)12)4(9)7(13,14)15/h1-2H3.
What are the key properties of 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene?
1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene has a molecular weight of 292.12 g/mol, XLogP of 4.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,5,5,5-heptafluoro-4,4-dimethyl-3-(trifluoromethyl)pent-2-ene is sourced from PubChem (CID 59892543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).