1,1,2,3,3,3-hexafluoropropan-1-ol

C3H2F6O — CID 11665471

IUPAC1,1,2,3,3,3-hexafluoropropan-1-ol
SMILESOC(F)(F)C(F)C(F)(F)F
InChIInChI=1S/C3H2F6O/c4-1(2(5,6)7)3(8,9)10/h1,10H
InChIKeyGWYGYHQOXMEUPT-UHFFFAOYSA-N
MW168.04 g/mol
LogP1.47
Rot. Bonds1

About 1,1,2,3,3,3-hexafluoropropan-1-ol

1,1,2,3,3,3-hexafluoropropan-1-ol (PubChem CID 11665471) has the molecular formula C3H2F6O and a molecular weight of 168.04 g/mol. Its IUPAC name is 1,1,2,3,3,3-hexafluoropropan-1-ol.

Molecular Properties

Compound Name1,1,2,3,3,3-hexafluoropropan-1-ol
PubChem CID11665471
Molecular FormulaC3H2F6O
Molecular Weight168.04 g/mol
Exact Mass168.00
IUPAC Name1,1,2,3,3,3-hexafluoropropan-1-ol
SMILESOC(F)(F)C(F)C(F)(F)F
InChIInChI=1S/C3H2F6O/c4-1(2(5,6)7)3(8,9)10/h1,10H
InChIKeyGWYGYHQOXMEUPT-UHFFFAOYSA-N
XLogP1.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.04
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3,3-hexafluoropropan-1-ol?
The IUPAC name of 1,1,2,3,3,3-hexafluoropropan-1-ol (CID 11665471) is 1,1,2,3,3,3-hexafluoropropan-1-ol.
What is the SMILES notation for 1,1,2,3,3,3-hexafluoropropan-1-ol?
The canonical SMILES for 1,1,2,3,3,3-hexafluoropropan-1-ol is OC(F)(F)C(F)C(F)(F)F.
What is the InChIKey of 1,1,2,3,3,3-hexafluoropropan-1-ol?
The InChIKey is GWYGYHQOXMEUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F6O/c4-1(2(5,6)7)3(8,9)10/h1,10H.
What are the key properties of 1,1,2,3,3,3-hexafluoropropan-1-ol?
1,1,2,3,3,3-hexafluoropropan-1-ol has a molecular weight of 168.04 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3,3-hexafluoropropan-1-ol is sourced from PubChem (CID 11665471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).