2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol

C6H5F7O2 — CID 20802269

IUPAC2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol
SMILESC=C(F)C(F)(F)OC(F)(CO)C(F)(F)F
InChIInChI=1S/C6H5F7O2/c1-3(7)5(9,10)15-4(8,2-14)6(11,12)13/h14H,1-2H2
InChIKeyLLDRNTSUZRKQPP-UHFFFAOYSA-N
MW242.09 g/mol
LogP2.30
Rot. Bonds4

About 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol

2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol (PubChem CID 20802269) has the molecular formula C6H5F7O2 and a molecular weight of 242.09 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol.

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol
PubChem CID20802269
Molecular FormulaC6H5F7O2
Molecular Weight242.09 g/mol
Exact Mass242.02
IUPAC Name2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol
SMILESC=C(F)C(F)(F)OC(F)(CO)C(F)(F)F
InChIInChI=1S/C6H5F7O2/c1-3(7)5(9,10)15-4(8,2-14)6(11,12)13/h14H,1-2H2
InChIKeyLLDRNTSUZRKQPP-UHFFFAOYSA-N
XLogP2.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.09
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol?
The IUPAC name of 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol (CID 20802269) is 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol.
What is the SMILES notation for 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol?
The canonical SMILES for 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol is C=C(F)C(F)(F)OC(F)(CO)C(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol?
The InChIKey is LLDRNTSUZRKQPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F7O2/c1-3(7)5(9,10)15-4(8,2-14)6(11,12)13/h14H,1-2H2.
What are the key properties of 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol?
2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol has a molecular weight of 242.09 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propan-1-ol is sourced from PubChem (CID 20802269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).