1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane

C6H3F11O — CID 175373278

IUPAC1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane
SMILESFC(C(F)(F)F)C(F)(F)OC(F)(F)CC(F)(F)F
InChIInChI=1S/C6H3F11O/c7-2(5(13,14)15)6(16,17)18-4(11,12)1-3(8,9)10/h2H,1H2
InChIKeyBNFPTALIRNYVMH-UHFFFAOYSA-N
MW300.07 g/mol
LogP4.04
Rot. Bonds4

About 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane

1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane (PubChem CID 175373278) has the molecular formula C6H3F11O and a molecular weight of 300.07 g/mol. Its IUPAC name is 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane.

Molecular Properties

Compound Name1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane
PubChem CID175373278
Molecular FormulaC6H3F11O
Molecular Weight300.07 g/mol
Exact Mass300.00
IUPAC Name1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane
SMILESFC(C(F)(F)F)C(F)(F)OC(F)(F)CC(F)(F)F
InChIInChI=1S/C6H3F11O/c7-2(5(13,14)15)6(16,17)18-4(11,12)1-3(8,9)10/h2H,1H2
InChIKeyBNFPTALIRNYVMH-UHFFFAOYSA-N
XLogP4.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.07
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane?
The IUPAC name of 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane (CID 175373278) is 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane.
What is the SMILES notation for 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane?
The canonical SMILES for 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane is FC(C(F)(F)F)C(F)(F)OC(F)(F)CC(F)(F)F.
What is the InChIKey of 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane?
The InChIKey is BNFPTALIRNYVMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3F11O/c7-2(5(13,14)15)6(16,17)18-4(11,12)1-3(8,9)10/h2H,1H2.
What are the key properties of 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane?
1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane has a molecular weight of 300.07 g/mol, XLogP of 4.04, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane is sourced from PubChem (CID 175373278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).