Hydroxy-PEG1-methyl ester - ≥98% , CAS No.93673-82-6

CAS: 93673-82-6 Cat. No.: H595580 Summenformel: C₆H₁₂O₄ Molekulargewicht: 148.16 PubChem CID: 15919658

GRADE & PURITY ≥98%

Synonyms

Hydroxy-PEG1-methyl ester | SCHEMBL9472095 | METHYL 3-(2-HYDROXYETHOXY)PROPANOATE | 3-(2-Hydroxyethoxy)propanoic acid methyl ester | METHYL3-(2-HYDROXYETHOXY)PROPANOATE | AKOS023093363 | HYDROXY-PEG1-METHYLESTER | C70644 | DTXSID10579595 | BP-23577 | Hydr

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Hydroxy-PEG1-methyl ester is a PEG derivative containing a hydroxyl group and a methyl ester. The hydrophilic PEG spacer increases solubility in aqueous media. The hydroxyl group enables further derivatization or replacement with other reactive functional groups. Methyl ester can be hydrolyzed under strong basic condition.

Specifications

Synonyme

Hydroxy-PEG1-methyl ester | SCHEMBL9472095 | METHYL 3-(2-HYDROXYETHOXY)PROPANOATE | 3-(2-Hydroxyethoxy)propanoic acid methyl ester | METHYL3-(2-HYDROXYETHOXY)PROPANOATE | AKOS023093363 | HYDROXY-PEG1-METHYLESTER | C70644 | DTXSID10579595 | BP-23577 | Hydr

Spezifikationen & Reinheit

≥98%

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Kanonisches Lächeln: COC(=O)CCOCCO
• IUPAC Name: methyl 3-(2-hydroxyethoxy)propanoate
• InChIKey: CQAKPCZOXXRLJA-UHFFFAOYSA-N
• INCHI: 1S/C6H12O4/c1-9-6(8)2-4-10-5-3-7/h7H,2-5H2,1H3
• Isomere SMILES: COC(=O)CCOCCO
• PubChem CID: 15919658
• Molekulargewicht: 148.16

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Ebene5 Carboxylic acid esters
          • Ebene6 Methyl esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters
• Direct Parent: Methyl esters
• Alternative Parents: Monocarboxylic acids and derivatives Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Methyl ester - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 148.160 g/mol
• XLogP3: -0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 148.074 Da
• Monoisotopic Mass: 148.074 Da
• Topological Polar Surface Area: 55.800 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 91.700
• 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