(3R)-3-hydroxy-2,3-dihydropyran-4-one

C5H6O3 — CID 52912335

IUPAC(3R)-3-hydroxy-2,3-dihydropyran-4-one
SMILESO=C1C=COC[C@H]1O
InChIInChI=1S/C5H6O3/c6-4-1-2-8-3-5(4)7/h1-2,5,7H,3H2/t5-/m1/s1
InChIKeyJDJSJECVPPBKSN-RXMQYKEDSA-N
MW114.10 g/mol
LogP-0.54
Rot. Bonds

About (3R)-3-hydroxy-2,3-dihydropyran-4-one

(3R)-3-hydroxy-2,3-dihydropyran-4-one (PubChem CID 52912335) has the molecular formula C5H6O3 and a molecular weight of 114.10 g/mol. Its IUPAC name is (3R)-3-hydroxy-2,3-dihydropyran-4-one.

Molecular Properties

Compound Name(3R)-3-hydroxy-2,3-dihydropyran-4-one
PubChem CID52912335
Molecular FormulaC5H6O3
Molecular Weight114.10 g/mol
Exact Mass114.03
IUPAC Name(3R)-3-hydroxy-2,3-dihydropyran-4-one
SMILESO=C1C=COC[C@H]1O
InChIInChI=1S/C5H6O3/c6-4-1-2-8-3-5(4)7/h1-2,5,7H,3H2/t5-/m1/s1
InChIKeyJDJSJECVPPBKSN-RXMQYKEDSA-N
XLogP-0.54
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.10
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-2,3-dihydropyran-4-one?
The IUPAC name of (3R)-3-hydroxy-2,3-dihydropyran-4-one (CID 52912335) is (3R)-3-hydroxy-2,3-dihydropyran-4-one.
What is the SMILES notation for (3R)-3-hydroxy-2,3-dihydropyran-4-one?
The canonical SMILES for (3R)-3-hydroxy-2,3-dihydropyran-4-one is O=C1C=COC[C@H]1O.
What is the InChIKey of (3R)-3-hydroxy-2,3-dihydropyran-4-one?
The InChIKey is JDJSJECVPPBKSN-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H6O3/c6-4-1-2-8-3-5(4)7/h1-2,5,7H,3H2/t5-/m1/s1.
What are the key properties of (3R)-3-hydroxy-2,3-dihydropyran-4-one?
(3R)-3-hydroxy-2,3-dihydropyran-4-one has a molecular weight of 114.10 g/mol, XLogP of -0.54, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-2,3-dihydropyran-4-one is sourced from PubChem (CID 52912335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).