2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane

C8H7F9O — CID 12626888

IUPAC2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane
SMILESFC(F)(F)C(C1CCCO1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H7F9O/c9-6(10,11)5(7(12,13)14,8(15,16)17)4-2-1-3-18-4/h4H,1-3H2
InChIKeyHRSJOEZBKUNNIM-UHFFFAOYSA-N
MW290.13 g/mol
LogP3.84
Rot. Bonds1

About 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane

2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane (PubChem CID 12626888) has the molecular formula C8H7F9O and a molecular weight of 290.13 g/mol. Its IUPAC name is 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane.

Molecular Properties

Compound Name2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane
PubChem CID12626888
Molecular FormulaC8H7F9O
Molecular Weight290.13 g/mol
Exact Mass290.04
IUPAC Name2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane
SMILESFC(F)(F)C(C1CCCO1)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H7F9O/c9-6(10,11)5(7(12,13)14,8(15,16)17)4-2-1-3-18-4/h4H,1-3H2
InChIKeyHRSJOEZBKUNNIM-UHFFFAOYSA-N
XLogP3.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.13
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Furan, 2,2,3,3,4,4-hexafluorotetrahydro-5-(2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl)-
CID 116761
Ncfuemzhjcqqpd-uhfffaoysa-
CID 12672279
2-Fluoro-2-(1,1,2,2,2-pentafluoroethyl)-3,3-bis(trifluoromethyl)oxolane
CID 12730902
2-(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxolane
CID 21810349
2-(1,1,1,2,3,3,4,4,4-Nonafluorobutan-2-yl)oxolane
CID 21967075
4,5-Bis(1,1-difluoroethyl)-2,2,3,3,4-pentafluorooxolane
CID 59288803
2-Fluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(1,1,2,2,3,3,3-heptafluoropropyl)-5-methyl-3-(trifluoromethyl)oxolane
CID 146454340
2-Fluoro-5-methyl-2-(1,1,2,2,2-pentafluoroethyl)-3,3-bis(trifluoromethyl)oxolane
CID 146454393
2-Fluoro-5-methyl-2,3,3-tris(trifluoromethyl)oxolane
CID 146535799
2-Fluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-5-methyl-3,3-bis(trifluoromethyl)oxolane
CID 146535802
2-Fluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3,3-bis(trifluoromethyl)oxolane
CID 146536163
2,3-Difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane
CID 146536164

Frequently Asked Questions

What is the IUPAC name of 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane?
The IUPAC name of 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane (CID 12626888) is 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane.
What is the SMILES notation for 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane?
The canonical SMILES for 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane is FC(F)(F)C(C1CCCO1)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane?
The InChIKey is HRSJOEZBKUNNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F9O/c9-6(10,11)5(7(12,13)14,8(15,16)17)4-2-1-3-18-4/h4H,1-3H2.
What are the key properties of 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane?
2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane has a molecular weight of 290.13 g/mol, XLogP of 3.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxolane is sourced from PubChem (CID 12626888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).