[5-(trifluoromethyl)furan-2-yl]methanol

C6H5F3O2 — CID 7537667

IUPAC[5-(trifluoromethyl)furan-2-yl]methanol
SMILESOCc1ccc(C(F)(F)F)o1
InChIInChI=1S/C6H5F3O2/c7-6(8,9)5-2-1-4(3-10)11-5/h1-2,10H,3H2
InChIKeyAISZOOJCHSJDOU-UHFFFAOYSA-N
MW166.10 g/mol
LogP1.79
Rot. Bonds1

About [5-(trifluoromethyl)furan-2-yl]methanol

[5-(trifluoromethyl)furan-2-yl]methanol (PubChem CID 7537667) has the molecular formula C6H5F3O2 and a molecular weight of 166.10 g/mol. Its IUPAC name is [5-(trifluoromethyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(trifluoromethyl)furan-2-yl]methanol
PubChem CID7537667
Molecular FormulaC6H5F3O2
Molecular Weight166.10 g/mol
Exact Mass166.02
IUPAC Name[5-(trifluoromethyl)furan-2-yl]methanol
SMILESOCc1ccc(C(F)(F)F)o1
InChIInChI=1S/C6H5F3O2/c7-6(8,9)5-2-1-4(3-10)11-5/h1-2,10H,3H2
InChIKeyAISZOOJCHSJDOU-UHFFFAOYSA-N
XLogP1.79
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.10
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [5-(trifluoromethyl)furan-2-yl]methanol?
The IUPAC name of [5-(trifluoromethyl)furan-2-yl]methanol (CID 7537667) is [5-(trifluoromethyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(trifluoromethyl)furan-2-yl]methanol?
The canonical SMILES for [5-(trifluoromethyl)furan-2-yl]methanol is OCc1ccc(C(F)(F)F)o1.
What is the InChIKey of [5-(trifluoromethyl)furan-2-yl]methanol?
The InChIKey is AISZOOJCHSJDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F3O2/c7-6(8,9)5-2-1-4(3-10)11-5/h1-2,10H,3H2.
What are the key properties of [5-(trifluoromethyl)furan-2-yl]methanol?
[5-(trifluoromethyl)furan-2-yl]methanol has a molecular weight of 166.10 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(trifluoromethyl)furan-2-yl]methanol is sourced from PubChem (CID 7537667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).