1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol

C6H5F9O2 — CID 22389969

IUPAC1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol
SMILESOC(F)(CF)C(F)(F)OC(F)(CF)C(F)(F)F
InChIInChI=1S/C6H5F9O2/c7-1-3(9,16)6(14,15)17-4(10,2-8)5(11,12)13/h16H,1-2H2
InChIKeyQNPGQSNZGSUSBR-UHFFFAOYSA-N
MW280.09 g/mol
LogP2.42
Rot. Bonds5

About 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol

1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol (PubChem CID 22389969) has the molecular formula C6H5F9O2 and a molecular weight of 280.09 g/mol. Its IUPAC name is 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Name1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol
PubChem CID22389969
Molecular FormulaC6H5F9O2
Molecular Weight280.09 g/mol
Exact Mass280.01
IUPAC Name1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol
SMILESOC(F)(CF)C(F)(F)OC(F)(CF)C(F)(F)F
InChIInChI=1S/C6H5F9O2/c7-1-3(9,16)6(14,15)17-4(10,2-8)5(11,12)13/h16H,1-2H2
InChIKeyQNPGQSNZGSUSBR-UHFFFAOYSA-N
XLogP2.42
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.09
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[[2,2-bis[difluoro-(1,1,1,2-tetrafluoro-3-hydroxypropan-2-yl)oxymethyl]-1,1,3,3-tetrafluoro-3-(1,1,1,2-tetrafluoro-3-hydroxypropan-2-yl)oxypropoxy]-difluoromethyl]-2-[difluoro-(1,1,1,2-tetrafluoro-3-hydroxypropan-2-yl)oxymethyl]-1,1,3,3-tetrafluoro-3-(1,1,1,2-tetrafluoro-3-hydroxypropan-2-yl)oxypropoxy]-2,3,3,3-tetrafluoropropan-1-ol
CID 59628167
1,1,1,2,3-pentafluoro-2-methanidyloxypropane;rutherfordium
CID 59937283
fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
CID 159599668
[2,2-difluoro-2-[1,1,2,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]ethyl] methyl carbonate
CID 122456553
fluoromethane;methane;1,1,1,2,3-pentafluoro-2-(2,2,2-trifluoroethoxy)propane;tetrafluoromethane
CID 161210390
2,2,3,3,4-pentafluorobutyl prop-2-enoate;3-prop-2-enoyloxypropyl prop-2-enoate;(2,3,3,3-tetrafluoro-2-fluorooxypropyl) prop-2-enoate;[2,3,3,3-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)propyl] prop-2-enoate
CID 91362069
[2-fluoro-1-hydroxy-1-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]ethyl] trifluoromethanesulfonate
CID 174345703
[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentoxy)propyl] prop-2-enoate
CID 71685931
4,5,5,5-tetrafluoro-4-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(trifluoromethoxy)propoxy]propoxy]pentan-1-ol
CID 151641249
methyl [2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2-tetrafluoropropoxy)propoxy]propyl] carbonate
CID 122450404
boric acid;tris(1,1,2-trifluoroethanol)
CID 175149497
1,1,3-trifluoropropan-1-ol
CID 18319092

Frequently Asked Questions

What is the IUPAC name of 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol?
The IUPAC name of 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol (CID 22389969) is 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol.
What is the SMILES notation for 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol?
The canonical SMILES for 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol is OC(F)(CF)C(F)(F)OC(F)(CF)C(F)(F)F.
What is the InChIKey of 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol?
The InChIKey is QNPGQSNZGSUSBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F9O2/c7-1-3(9,16)6(14,15)17-4(10,2-8)5(11,12)13/h16H,1-2H2.
What are the key properties of 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol?
1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol has a molecular weight of 280.09 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3-tetrafluoro-1-(1,1,1,2,3-pentafluoropropan-2-yloxy)propan-2-ol is sourced from PubChem (CID 22389969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).