3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol

C7H7F7O2 — CID 59705850

IUPAC3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol
SMILESCC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F
InChIInChI=1S/C7H7F7O2/c1-3(2)4(8,9)5(15,6(10,11)12)16-7(3,13)14/h15H,1-2H3
InChIKeyYHOOTERAMXYVMW-UHFFFAOYSA-N
MW256.12 g/mol
LogP2.52
Rot. Bonds

About 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol

3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol (PubChem CID 59705850) has the molecular formula C7H7F7O2 and a molecular weight of 256.12 g/mol. Its IUPAC name is 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol.

Molecular Properties

Compound Name3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol
PubChem CID59705850
Molecular FormulaC7H7F7O2
Molecular Weight256.12 g/mol
Exact Mass256.03
IUPAC Name3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol
SMILESCC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F
InChIInChI=1S/C7H7F7O2/c1-3(2)4(8,9)5(15,6(10,11)12)16-7(3,13)14/h15H,1-2H3
InChIKeyYHOOTERAMXYVMW-UHFFFAOYSA-N
XLogP2.52
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.12
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol?
The IUPAC name of 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol (CID 59705850) is 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol.
What is the SMILES notation for 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol?
The canonical SMILES for 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol is CC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F.
What is the InChIKey of 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol?
The InChIKey is YHOOTERAMXYVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F7O2/c1-3(2)4(8,9)5(15,6(10,11)12)16-7(3,13)14/h15H,1-2H3.
What are the key properties of 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol?
3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol has a molecular weight of 256.12 g/mol, XLogP of 2.52, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetrafluoro-4,4-dimethyl-2-(trifluoromethyl)oxolan-2-ol is sourced from PubChem (CID 59705850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).