3-(2-(3-Ethoxy-3-oxopropoxy)ethoxy)propanoic acid - ≥95% , CAS No.886362-90-9

CAS: 886362-90-9 Cat. No.: E304835 Formula: C₁₀H₁₈O₆ Peso molecolare: 234.25 Numero EC: 675-872-4

QUALITÀ & PUREZZA ≥95%

Synonyms

MFCD04115349 | 3-[2-(3-Ethoxy-3-oxopropoxy)ethoxy]propionic Acid | Acid-PEG2-ethyl propionate | 3-[2-(3-ethoxy-3-oxopropoxy)ethoxy]propanoic acid | FT-0730892 | DS-18138 | EN300-7419698 | SCHEMBL15758495 | 3-[2-(2-Ethoxycarbonyl-ethoxy)-ethoxy]-propionica

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifiche

Sinonimi

MFCD04115349 | 3-[2-(3-Ethoxy-3-oxopropoxy)ethoxy]propionic Acid | Acid-PEG2-ethyl propionate | 3-[2-(3-ethoxy-3-oxopropoxy)ethoxy]propanoic acid | FT-0730892 | DS-18138 | EN300-7419698 | SCHEMBL15758495 | 3-[2-(2-Ethoxycarbonyl-ethoxy)-ethoxy]-propionica

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Room temperature,Desiccated

Spedito in

Normal

Purezza

≥95%

Nomi e identificatori

Pubchem Sid

488200873

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488200873

Sorrisi canonici

CCOC(=O)CCOCCOCCC(=O)O

IUPAC Name

3-[2-(3-ethoxy-3-oxopropoxy)ethoxy]propanoic acid

InChIKey

KEGUKRRJONEXNN-UHFFFAOYSA-N

INCHI

1S/C10H18O6/c1-2-16-10(13)4-6-15-8-7-14-5-3-9(11)12/h2-8H2,1H3,(H,11,12)

Isomeri SMILES

CCOC(=O)CCOCCOCCC(=O)O

Peso molecolare

234.25

Reaxy-Rn

35719987

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=35719987&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Dicarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Dicarboxylic acids and derivatives
• Alternative Parents: Carboxylic acid esters Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dicarboxylic acid or derivatives - Carboxylic acid ester - 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 dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups.
• 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

• Punto di ebollizione (°C): 370.8 °C at 760 mmHg
• Peso molecolare: 234.250 g/mol
• XLogP3: -0.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 234.11 Da
• Monoisotopic Mass: 234.11 Da
• Topological Polar Surface Area: 82.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 203.000
• 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