4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol

C8H8F8O2 — CID 59705840

IUPAC4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol
SMILESCCC1(C(F)(F)F)COC(O)(C(F)(F)F)C1(F)F
InChIInChI=1S/C8H8F8O2/c1-2-4(7(11,12)13)3-18-6(17,5(4,9)10)8(14,15)16/h17H,2-3H2,1H3
InChIKeyYCKOHORDSNCIHG-UHFFFAOYSA-N
MW288.13 g/mol
LogP2.86
Rot. Bonds1

About 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol

4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol (PubChem CID 59705840) has the molecular formula C8H8F8O2 and a molecular weight of 288.13 g/mol. Its IUPAC name is 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol.

Molecular Properties

Compound Name4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol
PubChem CID59705840
Molecular FormulaC8H8F8O2
Molecular Weight288.13 g/mol
Exact Mass288.04
IUPAC Name4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol
SMILESCCC1(C(F)(F)F)COC(O)(C(F)(F)F)C1(F)F
InChIInChI=1S/C8H8F8O2/c1-2-4(7(11,12)13)3-18-6(17,5(4,9)10)8(14,15)16/h17H,2-3H2,1H3
InChIKeyYCKOHORDSNCIHG-UHFFFAOYSA-N
XLogP2.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.13
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol?
The IUPAC name of 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol (CID 59705840) is 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol.
What is the SMILES notation for 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol?
The canonical SMILES for 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol is CCC1(C(F)(F)F)COC(O)(C(F)(F)F)C1(F)F.
What is the InChIKey of 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol?
The InChIKey is YCKOHORDSNCIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F8O2/c1-2-4(7(11,12)13)3-18-6(17,5(4,9)10)8(14,15)16/h17H,2-3H2,1H3.
What are the key properties of 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol?
4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol has a molecular weight of 288.13 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,3-difluoro-2,4-bis(trifluoromethyl)oxolan-2-ol is sourced from PubChem (CID 59705840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).