2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid

C8H6O9 — CID 19432155

IUPAC2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid
SMILESO=C(O)C1=C(C(=O)O)C(C(=O)O)OC1C(=O)O
InChIInChI=1S/C8H6O9/c9-5(10)1-2(6(11)12)4(8(15)16)17-3(1)7(13)14/h3-4H,(H,9,10)(H,11,12)(H,13,14)(H,15,16)
InChIKeyGLSWZJSERICNIV-UHFFFAOYSA-N
MW246.13 g/mol
LogP-1.61
Rot. Bonds4

About 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid

2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid (PubChem CID 19432155) has the molecular formula C8H6O9 and a molecular weight of 246.13 g/mol. Its IUPAC name is 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid.

Molecular Properties

Compound Name2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid
PubChem CID19432155
Molecular FormulaC8H6O9
Molecular Weight246.13 g/mol
Exact Mass246.00
IUPAC Name2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid
SMILESO=C(O)C1=C(C(=O)O)C(C(=O)O)OC1C(=O)O
InChIInChI=1S/C8H6O9/c9-5(10)1-2(6(11)12)4(8(15)16)17-3(1)7(13)14/h3-4H,(H,9,10)(H,11,12)(H,13,14)(H,15,16)
InChIKeyGLSWZJSERICNIV-UHFFFAOYSA-N
XLogP-1.61
TPSA158.43 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.13
LogP ≤ 5-1.61
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

Pfcfyvvmubkymt-uhfffaoysa-
CID 11074751
Diethyl 4-ethyl-2,5-dihydrofuran-2,3-dicarboxylate
CID 15367226
(+/-)-Transepoxyaconitic acid
CID 20463650
3,6-dihydro-2H-pyran-3,4,5,6-tetracarboxylic acid
CID 20317499
Tetrasodium;2,5-dihydrofuran-2,3,4,5-tetracarboxylate
CID 22623777
2,3-dihydroxybutanedioic acid;(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one
CID 54683891
4-[[(2R)-2-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-yl]oxy]-2,3-dihydroxy-4-oxobutanoic acid
CID 66713913
Tetrapotassium;2,5-dihydrofuran-2,3,4,5-tetracarboxylate
CID 68149690
4,5-dihydroxy-5-methyl-2H-furan-2,3-dicarboxylic acid
CID 68422008
5,6-dioxo-2H-pyran-2,4-dicarboxylic acid
CID 68484117
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one;2-hydroxybutanedioic acid
CID 70235119
(2Z)-2-[2-(1,2-dicarboxy-2-hydroxyethoxy)-2-oxoethylidene]butanedioic acid
CID 87301058

Frequently Asked Questions

What is the IUPAC name of 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid?
The IUPAC name of 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid (CID 19432155) is 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid.
What is the SMILES notation for 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid?
The canonical SMILES for 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid is O=C(O)C1=C(C(=O)O)C(C(=O)O)OC1C(=O)O.
What is the InChIKey of 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid?
The InChIKey is GLSWZJSERICNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O9/c9-5(10)1-2(6(11)12)4(8(15)16)17-3(1)7(13)14/h3-4H,(H,9,10)(H,11,12)(H,13,14)(H,15,16).
What are the key properties of 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid?
2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid has a molecular weight of 246.13 g/mol, XLogP of -1.61, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydrofuran-2,3,4,5-tetracarboxylic acid is sourced from PubChem (CID 19432155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).