Methyl glycolate - ≥98% , CAS No.96-35-5

CAS: 96-35-5 Cat. No.: M101718 Formula: C₃H₆O₃ Peso molecolare: 90.08 Beilstein Registry Number: 1699571 Numero EC: 202-502-7

GRADE & PURITY ≥98%

Synonyms

7G7R729EJ0 | EINECS 202-502-7 | NSC 27786 | Q27894348 | SB83763 | SY003097 | methyl 2-hydroxyacetate | NSC27786 | NSC-27786 | G0199 | methyl2-hydroxyethanoate | EN300-42324 | Methyl hydroxyacetate | STL141090 | UNII-7G7R729EJ0 | FT-0628738 | DTXSID3059131

Storage

Room temperature

Shipped In

Normal

Panoramica

Synthesis of methyl glycolate from the carbonylation of HCHO using heteropoly acids (HPAs) as catalysts, followed by esterification with methanol was reported. Size-selective vibrational spectroscopy of methyl glycolate clusters was reported.

Methyl glycolate is a chemical reagent used in the synthesis of taxol and rapamycin. It is used in leather tanning and textile dyeing. It acts as a flavoring agent, preservative in food processing, in water treatment industries and as chemical intermediates. Further, it is used in emulsion polymers, ink and paint additive to improve flow properties and impart gloss. It plays an important role in producing triisopropylsilanyloxy-acetic acid methyl ester using imidazole as reagent.

Specifications

Sinonimi

7G7R729EJ0 | EINECS 202-502-7 | NSC 27786 | Q27894348 | SB83763 | SY003097 | methyl 2-hydroxyacetate | NSC27786 | NSC-27786 | G0199 | methyl2-hydroxyethanoate | EN300-42324 | Methyl hydroxyacetate | STL141090 | UNII-7G7R729EJ0 | FT-0628738 | DTXSID3059131

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

488183851

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488183851

Sorrisi canonici

COC(=O)CO

IUPAC Name

methyl 2-hydroxyacetate

InChIKey

GSJFXBNYJCXDGI-UHFFFAOYSA-N

INCHI

1S/C3H6O3/c1-6-3(5)2-4/h4H,2H2,1H3

Isomeri SMILES

COC(=O)CO

WGK Germania

3

Peso molecolare

90.08

Beilstein

1699571

Reaxy-Rn

1699571

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699571&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid esters
          • Level6 Methyl esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters
• Direct Parent: Methyl esters
• Alternative Parents: Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Methyl ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl group.
• 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

Proprietà chimiche e fisiche

• Solubilità: Miscible with water.
• Indice di rifrazione: 1.417
• Punto di infiammabilità (°F): 152.6 °F
• Punto di infiammabilità (°C): 67 °C
• Punto di ebollizione (°C): 149-151°C
• Peso molecolare: 90.080 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 90.0317 Da
• Monoisotopic Mass: 90.0317 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 50.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1