2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol

C5H5F5O2 — CID 173004592

IUPAC2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol
SMILESOCCOC(F)(F)C(F)=C(F)F
InChIInChI=1S/C5H5F5O2/c6-3(4(7)8)5(9,10)12-2-1-11/h11H,1-2H2
InChIKeyBORJMPATKSZMFG-UHFFFAOYSA-N
MW192.08 g/mol
LogP1.67
Rot. Bonds4

About 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol

2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol (PubChem CID 173004592) has the molecular formula C5H5F5O2 and a molecular weight of 192.08 g/mol. Its IUPAC name is 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol.

Molecular Properties

Compound Name2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol
PubChem CID173004592
Molecular FormulaC5H5F5O2
Molecular Weight192.08 g/mol
Exact Mass192.02
IUPAC Name2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol
SMILESOCCOC(F)(F)C(F)=C(F)F
InChIInChI=1S/C5H5F5O2/c6-3(4(7)8)5(9,10)12-2-1-11/h11H,1-2H2
InChIKeyBORJMPATKSZMFG-UHFFFAOYSA-N
XLogP1.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.08
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 59628110
CID 59628110
CID 146426173
CID 146426173
CID 153446275
CID 153446275
CID 101004429
CID 101004429
CID 101082385
CID 101082385
CID 178244300
CID 178244300

Frequently Asked Questions

What is the IUPAC name of 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol?
The IUPAC name of 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol (CID 173004592) is 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol.
What is the SMILES notation for 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol?
The canonical SMILES for 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol is OCCOC(F)(F)C(F)=C(F)F.
What is the InChIKey of 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol?
The InChIKey is BORJMPATKSZMFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F5O2/c6-3(4(7)8)5(9,10)12-2-1-11/h11H,1-2H2.
What are the key properties of 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol?
2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol has a molecular weight of 192.08 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,2,3,3-pentafluoroprop-2-enoxy)ethanol is sourced from PubChem (CID 173004592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).