(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one

C8H10O3 — CID 139206800

IUPAC(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one
SMILESC/C=C/[C@H]1CC(O)=CC(=O)O1
InChIInChI=1S/C8H10O3/c1-2-3-7-4-6(9)5-8(10)11-7/h2-3,5,7,9H,4H2,1H3/b3-2+/t7-/m0/s1
InChIKeyDSNLOSVQPUKAOK-AIYRYJHASA-N
MW154.16 g/mol
LogP1.32
Rot. Bonds1

About (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one

(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one (PubChem CID 139206800) has the molecular formula C8H10O3 and a molecular weight of 154.16 g/mol. Its IUPAC name is (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one.

Molecular Properties

Compound Name(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one
PubChem CID139206800
Molecular FormulaC8H10O3
Molecular Weight154.16 g/mol
Exact Mass154.06
IUPAC Name(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one
SMILESC/C=C/[C@H]1CC(O)=CC(=O)O1
InChIInChI=1S/C8H10O3/c1-2-3-7-4-6(9)5-8(10)11-7/h2-3,5,7,9H,4H2,1H3/b3-2+/t7-/m0/s1
InChIKeyDSNLOSVQPUKAOK-AIYRYJHASA-N
XLogP1.32
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.16
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

5,6-Dihydro-4-methoxy-6-methyl-2H-pyran-2-one
CID 229844
6-propyl-5,6-dihydro-2H-pyran-2-one
CID 13949543
(E)-3-(4-methoxy-3-methyl-6-oxo-2,3-dihydropyran-2-yl)prop-2-enoic acid
CID 44566950
2-Hydroxy-5,6-dihydropyran-4-one
CID 54681902
4-hydroxy-6-methyl-5,6-dihydro-2H-pyran-2-one
CID 54680536
Euscapholide
CID 100956117
Pyrenocine C
CID 6439921
Lasiolactone
CID 89352705
5-[(E,1R)-1-hydroxybut-2-enyl]-4-methoxy-6-methylpyran-2-one
CID 134159025
2-Ethyl-4-methoxy-2,3-dihydropyran-6-one
CID 12213829
ethyl (E,5S)-5-hydroxyhex-2-enoate
CID 11332611
4-Hydroxy-3,6-dimethyl-5,6-dihydro-2-pyrone
CID 54696332

Frequently Asked Questions

What is the IUPAC name of (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one?
The IUPAC name of (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one (CID 139206800) is (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one.
What is the SMILES notation for (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one?
The canonical SMILES for (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one is C/C=C/[C@H]1CC(O)=CC(=O)O1.
What is the InChIKey of (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one?
The InChIKey is DSNLOSVQPUKAOK-AIYRYJHASA-N. The full InChI is InChI=1S/C8H10O3/c1-2-3-7-4-6(9)5-8(10)11-7/h2-3,5,7,9H,4H2,1H3/b3-2+/t7-/m0/s1.
What are the key properties of (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one?
(2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one has a molecular weight of 154.16 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-hydroxy-2-[(E)-prop-1-enyl]-2,3-dihydropyran-6-one is sourced from PubChem (CID 139206800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).