(2R)-5-hexyl-4-hydroxy-2-undecyl-2,3-dihydropyran-6-one - ≥97% , CAS No.112764-00-8

CAS: 112764-00-8 Cat. No.: H626932 Molecular Weight: 352.55 EC Number: 603-982-4 PubChem CID: 54684708

GRADE & PURITY ≥97%

Synonyms

SCHEMBL2819252 | rac-5,6-dihydro-3-hexyl-4-hydroxy-6-undecyl-2H-pyran-2-one | 3-Hexyl-4-hydroxy-6-undecyl-5,6-dihydro-2H-pyran-2-one | DTXSID00715743 | (R)-3-Hexyl-4-hydroxy-6-undecyl-5,6-dihydro-2H-pyran-2-one | 5-hexyl-4-hydroxy-2-undecyl-2,3-dihydropyr

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

SCHEMBL2819252 | rac-5, 6-dihydro-3-hexyl-4-hydroxy-6-undecyl-2H-pyran-2-one | 3-Hexyl-4-hydroxy-6-undecyl-5, 6-dihydro-2H-pyran-2-one | DTXSID00715743 | (R)-3-Hexyl-4-hydroxy-6-undecyl-5, 6-dihydro-2H-pyran-2-one | 5-hexyl-4-hydroxy-2-undecyl-2, 3-dihydropyr

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCC1CC(=C(C(=O)O1)CCCCCC)O
• IUPAC Name: 5-hexyl-4-hydroxy-2-undecyl-2,3-dihydropyran-6-one
• InChIKey: BLXCWAINNUGTQE-UHFFFAOYSA-N
• INCHI: 1S/C22H40O3/c1-3-5-7-9-10-11-12-13-14-16-19-18-21(23)20(22(24)25-19)17-15-8-6-4-2/h19,23H,3-18H2,1-2H3
• Isomeric SMILES: CCCCCCCCCCCC1CC(=C(C(=O)O1)CCCCCC)O
• Alternate CAS: 112764-00-8,136890-21-6
• PubChem CID: 54684708
• Molecular Weight: 352.55

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyrans
      • Subclass Pyranones and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyrans
• Subclass: Pyranones and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dihydropyranones
• Alternative Parents: Vinylogous acids Enoate esters Lactones Oxacyclic compounds Monocarboxylic acids and derivatives Enols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Dihydropyranone - Enoate ester - Vinylogous acid - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Enol - Monocarboxylic acid or derivatives - Oxacycle - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dihydropyranones. These are compounds containing a hydrogenated pyran ring which bears a ketone, and contains one double bond.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y