(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid

C5H6O5 — CID 45084685

IUPAC(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid
SMILESO=C1C[C@](O)(C(=O)O)CO1
InChIInChI=1S/C5H6O5/c6-3-1-5(9,2-10-3)4(7)8/h9H,1-2H2,(H,7,8)/t5-/m1/s1
InChIKeyVCYINFNRMDFDMP-RXMQYKEDSA-N
MW146.10 g/mol
LogP-1.25
Rot. Bonds1

About (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid

(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid (PubChem CID 45084685) has the molecular formula C5H6O5 and a molecular weight of 146.10 g/mol. Its IUPAC name is (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid
PubChem CID45084685
Molecular FormulaC5H6O5
Molecular Weight146.10 g/mol
Exact Mass146.02
IUPAC Name(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid
SMILESO=C1C[C@](O)(C(=O)O)CO1
InChIInChI=1S/C5H6O5/c6-3-1-5(9,2-10-3)4(7)8/h9H,1-2H2,(H,7,8)/t5-/m1/s1
InChIKeyVCYINFNRMDFDMP-RXMQYKEDSA-N
XLogP-1.25
TPSA83.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.10
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,4-Dimethyl 2-hydroxy-2-methylbutanedioate
CID 519625
3,4-Dihydroxy-3-methyloxolan-2-one
CID 11469098
(3R,4R)-3,4-Dihydroxy-3-methyloxolan-2-one
CID 11126294
D-Apionolactone
CID 124080856
beta-Hydroxyparaconic Acid
CID 14778487
4-Hydroxy-4-(hydroxymethyl)oxolan-2-one
CID 18783249
Methyl 3-hydroxyoxolane-3-carboxylate
CID 63333090
(3R)-3-hydroxy-4-methoxy-3-methyl-4-oxobutanoic acid
CID 131231414
Itaconate epoxide
CID 146858
(3S,4R)-3,4-dihydroxy-3-methyloxolan-2-one
CID 11116103
2-Methyloxirane-2,3-dicarboxylic acid
CID 19003955
3-(Propan-2-yloxy)oxolane-3-carboxylic acid
CID 115014247

Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid?
The IUPAC name of (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid (CID 45084685) is (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid.
What is the SMILES notation for (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid?
The canonical SMILES for (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid is O=C1C[C@](O)(C(=O)O)CO1.
What is the InChIKey of (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid?
The InChIKey is VCYINFNRMDFDMP-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H6O5/c6-3-1-5(9,2-10-3)4(7)8/h9H,1-2H2,(H,7,8)/t5-/m1/s1.
What are the key properties of (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid?
(3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid has a molecular weight of 146.10 g/mol, XLogP of -1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-5-oxooxolane-3-carboxylic acid is sourced from PubChem (CID 45084685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).