2-(2-Methoxyethoxy)acetic acid - technical grade , CAS No.16024-56-9

CAS: 16024-56-9 Cat. No.: M138320 Formula: CH₃OCH₂CH₂OCH₂CO₂H Peso molecolare: 134.13 Beilstein Registry Number: 1753567 Numero EC: 240-161-6

GRADE & PURITY Technical grade

Synonyms

DTXSID90166841 | BP-26112 | SY035294 | 3,6-dioxaheptanoic acid | m-PEG-CH2CO2H, MW 1,000 | 2-(2-methoxyethoxy)acetic acid (90%) | BP-23667 | m-PEG-CH2CO2H, MW 10,000 | AKOS000120427 | SCHEMBL157312 | 2-(2-Methoxyethoxy)acetic acid | 2-(2-methoxyethoxy)-ac

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

DTXSID90166841 | BP-26112 | SY035294 | 3,6-dioxaheptanoic acid | m-PEG-CH2CO2H, MW 1,000 | 2-(2-methoxyethoxy)acetic acid (90%) | BP-23667 | m-PEG-CH2CO2H, MW 10,000 | AKOS000120427 | SCHEMBL157312 | 2-(2-Methoxyethoxy)acetic acid | 2-(2-methoxyethoxy)-ac

Specifiche e purezza

technical grade

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Grado

Grado tecnico

Nomi e identificatori

• Pubchem Sid: 488183053
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183053
• Sorrisi canonici: COCCOCC(=O)O
• IUPAC Name: 2-(2-methoxyethoxy)acetic acid
• InChIKey: CLLLODNOQBVIMS-UHFFFAOYSA-N
• INCHI: 1S/C5H10O4/c1-8-2-3-9-4-5(6)7/h2-4H2,1H3,(H,6,7)
• Isomeri SMILES: COCCOCC(=O)O
• WGK Germania: 1
• Peso molecolare: 134.13
• Beilstein: 1753567
• Reaxy-Rn: 1753567
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1753567&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
• 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

• Indice di rifrazione: 1.436
• Punto di ebollizione (°C): 245-250 °C
• Peso molecolare: 134.130 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 134.058 Da
• Monoisotopic Mass: 134.058 Da
• Topological Polar Surface Area: 55.800 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 81.000
• 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

Riferimenti

1. Jing Wang, Haijun Bi, Mengru Li, Hui Wang, Manman Xue, Jieyao Yu, Chi-Tang Ho, Liang Zhang, Qinglin Zhuo, Jiadao Jiang, Xiaochun Wan, Xiaoting Zhai.  (2023)  Contribution of theanine to the temperature-induced changes in aroma profile of Wuyi rock tea.  FOOD RESEARCH INTERNATIONAL,      [PMID:37254434] [10.1016/j.foodres.2023.112860]