5-Hydroxy-2-hexenoic acid lactone

Base Information

• Chemical Name: 5-Hydroxy-2-hexenoic acid lactone
• CAS No.: 108-54-3
• Molecular Formula: C6H8 O2
• Molecular Weight: 112.13
• European Community (EC) Number: 854-224-6
• NSC Number: 24508
• DSSTox Substance ID: DTXSID50871944
• Nikkaji Number: J79.447C
• Wikidata: Q104991451
• Mol file: 108-54-3.mol

Synonyms:108-54-3;6-Methyl-5,6-dihydro-2H-pyran-2-one;5-Hydroxy-2-hexenoic acid lactone;2-methyl-2,3-dihydropyran-6-one;6-methyl-5,6-dihydropyran-2-one;2H-Pyran-2-one, 5,6-dihydro-6-methyl-;NSC 24508;starbld0047975;5,6-DIHYDRO-6-METHYL-2H-PYRAN-2-ONE;SCHEMBL979332;DTXSID50871944;NSC24508;NSC-24508;AKOS028108406;2H-Pyran-2-one,6-dihydro-6-methyl-;D-lactone of 5-hydroxy-2-hexenoic acid;LS-127436;EN300-7597993;Z1509022444

Chemical Property of 5-Hydroxy-2-hexenoic acid lactone

Chemical Property:

• Boiling Point: 110 °C(Press: 15 Torr)
• PSA: 26.30000
• Density: 1.045±0.06 g/cm3(Predicted)
• LogP: 0.87800
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 112.052429494
• Heavy Atom Count: 8
• Complexity: 127

Purity/Quality:

98%,99%, ^*data from raw suppliers

6-Methyl-5,6-dihydropyran-2-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC=CC(=O)O1

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