2-(furan-2-yl)-2-hydroxypropanoic acid

C7H8O4 — CID 83694667

IUPAC2-(furan-2-yl)-2-hydroxypropanoic acid
SMILESCC(O)(C(=O)O)c1ccco1
InChIInChI=1S/C7H8O4/c1-7(10,6(8)9)5-3-2-4-11-5/h2-4,10H,1H3,(H,8,9)
InChIKeyWNTKJHQICCASCJ-UHFFFAOYSA-N
MW156.14 g/mol
LogP0.57
Rot. Bonds2

About 2-(furan-2-yl)-2-hydroxypropanoic acid

2-(furan-2-yl)-2-hydroxypropanoic acid (PubChem CID 83694667) has the molecular formula C7H8O4 and a molecular weight of 156.14 g/mol. Its IUPAC name is 2-(furan-2-yl)-2-hydroxypropanoic acid.

Molecular Properties

Compound Name2-(furan-2-yl)-2-hydroxypropanoic acid
PubChem CID83694667
Molecular FormulaC7H8O4
Molecular Weight156.14 g/mol
Exact Mass156.04
IUPAC Name2-(furan-2-yl)-2-hydroxypropanoic acid
SMILESCC(O)(C(=O)O)c1ccco1
InChIInChI=1S/C7H8O4/c1-7(10,6(8)9)5-3-2-4-11-5/h2-4,10H,1H3,(H,8,9)
InChIKeyWNTKJHQICCASCJ-UHFFFAOYSA-N
XLogP0.57
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.14
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2-hydroxypropanoic acid?
The IUPAC name of 2-(furan-2-yl)-2-hydroxypropanoic acid (CID 83694667) is 2-(furan-2-yl)-2-hydroxypropanoic acid.
What is the SMILES notation for 2-(furan-2-yl)-2-hydroxypropanoic acid?
The canonical SMILES for 2-(furan-2-yl)-2-hydroxypropanoic acid is CC(O)(C(=O)O)c1ccco1.
What is the InChIKey of 2-(furan-2-yl)-2-hydroxypropanoic acid?
The InChIKey is WNTKJHQICCASCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O4/c1-7(10,6(8)9)5-3-2-4-11-5/h2-4,10H,1H3,(H,8,9).
What are the key properties of 2-(furan-2-yl)-2-hydroxypropanoic acid?
2-(furan-2-yl)-2-hydroxypropanoic acid has a molecular weight of 156.14 g/mol, XLogP of 0.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2-hydroxypropanoic acid is sourced from PubChem (CID 83694667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).