5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane

C10H8F12O — CID 146536174

IUPAC5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane
SMILESCCC1CC(F)(C(F)(F)F)C(F)(C(F)(C(F)(F)F)C(F)(F)F)O1
InChIInChI=1S/C10H8F12O/c1-2-4-3-5(11,8(14,15)16)7(13,23-4)6(12,9(17,18)19)10(20,21)22/h4H,2-3H2,1H3
InChIKeyGEBHGIFXJBVNOI-UHFFFAOYSA-N
MW372.15 g/mol
LogP4.95
Rot. Bonds2

About 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane

5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane (PubChem CID 146536174) has the molecular formula C10H8F12O and a molecular weight of 372.15 g/mol. Its IUPAC name is 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane.

Molecular Properties

Compound Name5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane
PubChem CID146536174
Molecular FormulaC10H8F12O
Molecular Weight372.15 g/mol
Exact Mass372.04
IUPAC Name5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane
SMILESCCC1CC(F)(C(F)(F)F)C(F)(C(F)(C(F)(F)F)C(F)(F)F)O1
InChIInChI=1S/C10H8F12O/c1-2-4-3-5(11,8(14,15)16)7(13,23-4)6(12,9(17,18)19)10(20,21)22/h4H,2-3H2,1H3
InChIKeyGEBHGIFXJBVNOI-UHFFFAOYSA-N
XLogP4.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.15
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane with MolForge

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Related Compounds

Ncfuemzhjcqqpd-uhfffaoysa-
CID 12672279
2-(1,1,1,2,3,4,4,4-Octafluorobutan-2-yl)oxolane
CID 13271513
2-(1,2,2,3,3,4,4,5-Octafluorocyclopentyl)oxolane
CID 13451002
3-(2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl)-4-methyloxolane
CID 85267668
3-Methyl-4-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptyl)oxolane
CID 101115659
3-Methyl-4-(2,2,3,3,4,4,5,5-octafluoropentyl)oxolane
CID 101115660
2-(2,2,3,3,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Icosafluoro-4-methylundecyl)oxirane
CID 19707541
2-(2,2,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Hexadecafluoro-3-methylnonyl)oxirane
CID 19707572
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
2,5-Diethyl-3,4-bis(trifluoromethyl)oxolane
CID 20771104
2,5-Diethyl-3-(trifluoromethyl)oxolane
CID 20771105
2-(1,1,1,2,3,3,4,4,4-Nonafluorobutan-2-yl)oxolane
CID 21967075

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane?
The IUPAC name of 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane (CID 146536174) is 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane.
What is the SMILES notation for 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane?
The canonical SMILES for 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane is CCC1CC(F)(C(F)(F)F)C(F)(C(F)(C(F)(F)F)C(F)(F)F)O1.
What is the InChIKey of 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane?
The InChIKey is GEBHGIFXJBVNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F12O/c1-2-4-3-5(11,8(14,15)16)7(13,23-4)6(12,9(17,18)19)10(20,21)22/h4H,2-3H2,1H3.
What are the key properties of 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane?
5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane has a molecular weight of 372.15 g/mol, XLogP of 4.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,3-difluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-(trifluoromethyl)oxolane is sourced from PubChem (CID 146536174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).