1,1,2,3,3-pentafluoro-1,3-dimethoxypropane

C5H7F5O2 — CID 13319074

IUPAC1,1,2,3,3-pentafluoro-1,3-dimethoxypropane
SMILESCOC(F)(F)C(F)C(F)(F)OC
InChIInChI=1S/C5H7F5O2/c1-11-4(7,8)3(6)5(9,10)12-2/h3H,1-2H3
InChIKeyQXFWMCWAGHYFKP-UHFFFAOYSA-N
MW194.10 g/mol
LogP1.80
Rot. Bonds4

About 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane

1,1,2,3,3-pentafluoro-1,3-dimethoxypropane (PubChem CID 13319074) has the molecular formula C5H7F5O2 and a molecular weight of 194.10 g/mol. Its IUPAC name is 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane.

Molecular Properties

Compound Name1,1,2,3,3-pentafluoro-1,3-dimethoxypropane
PubChem CID13319074
Molecular FormulaC5H7F5O2
Molecular Weight194.10 g/mol
Exact Mass194.04
IUPAC Name1,1,2,3,3-pentafluoro-1,3-dimethoxypropane
SMILESCOC(F)(F)C(F)C(F)(F)OC
InChIInChI=1S/C5H7F5O2/c1-11-4(7,8)3(6)5(9,10)12-2/h3H,1-2H3
InChIKeyQXFWMCWAGHYFKP-UHFFFAOYSA-N
XLogP1.80
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.10
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane?
The IUPAC name of 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane (CID 13319074) is 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane.
What is the SMILES notation for 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane?
The canonical SMILES for 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane is COC(F)(F)C(F)C(F)(F)OC.
What is the InChIKey of 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane?
The InChIKey is QXFWMCWAGHYFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F5O2/c1-11-4(7,8)3(6)5(9,10)12-2/h3H,1-2H3.
What are the key properties of 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane?
1,1,2,3,3-pentafluoro-1,3-dimethoxypropane has a molecular weight of 194.10 g/mol, XLogP of 1.80, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3-pentafluoro-1,3-dimethoxypropane is sourced from PubChem (CID 13319074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).