(S)-β-Hydroxy-γ-butyrolactone - ≥80% , CAS No.7331-52-4

CAS: 7331-52-4 Cat. No.: H1098216 Molecular Weight: 102.09 Beilstein Registry Number: 4657152 EC Number: 434-990-4

GRADE & PURITY ≥80%

Synonyms

(S)-3-Hydroxy-gamma-butyrolactone | (S)-4-Hydroxytetrahydrofuran-2-one | (S)-β-Hydroxy-γ-butyrolactone | (S)-4,5-Dihydro-4-hydroxy-2(3H)-furanone

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

(S)-3-Hydroxy-gamma-butyrolactone | (S)-4-Hydroxytetrahydrofuran-2-one | (S)-β-Hydroxy-γ-butyrolactone | (S)-4, 5-Dihydro-4-hydroxy-2(3H)-furanone

Specifications & Purity

≥80%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥80%

Names and Identifiers

• Canonical Smiles: C1C(COC1=O)O
• IUPAC Name: (4S)-4-hydroxyoxolan-2-one
• InChIKey: FUDDLSHBRSNCBV-VKHMYHEASA-N
• INCHI: 1S/C4H6O3/c5-3-1-4(6)7-2-3/h3,5H,1-2H2/t3-/m0/s1
• Isomeric SMILES: C1[C@@H](COC1=O)O
• WGK Germany: 3
• Molecular Weight: 102.09
• Beilstein: 4657152
• Reaxy-Rn: 107670
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107670&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Lactones
      • Subclass Gamma butyrolactones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Lactones
• Subclass: Gamma butyrolactones
• Intermediate Tree Nodes: Not available
• Direct Parent: Gamma butyrolactones
• Alternative Parents: Oxolanes Secondary alcohols Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Gamma butyrolactone - Oxolane - Secondary alcohol - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.
• 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

Chemical and Physical Properties

• Refractive Index: 1.464
• Specific Rotation[α]: -83 ° (C=2, EtOH)
• Flash Point(°F): 228.2 °F
• Flash Point(°C): 109 °C
• Boil Point(°C): 98-100°C