Dimethyl azelate - ≥98.5%(GC) , CAS No.1732-10-1

CAS: 1732-10-1 Cat. No.: D465414 Formula: C₁₁H₂₀O₄ Peso molecolare: 216.28 Numero EC: 217-060-0

GRADE & PURITY ≥98.5%(GC)

Synonyms

NSC 59040 | EINECS 217-060-0 | FT-0622519 | UNII-29185K7OEI | AKOS015913922 | dimethyl nonane-1,9-dioate | Tox21_301713 | Methyl azelate | AMY32452 | Dimethyl azelaate | Dimethyl azelate, >=98.5% (GC) | Nonanedioic acid, dimethyl ester | BCP23026 | Nonane

Storage

Room temperature

Specifications

Sinonimi

NSC 59040 | EINECS 217-060-0 | FT-0622519 | UNII-29185K7OEI | AKOS015913922 | dimethyl nonane-1,9-dioate | Tox21_301713 | Methyl azelate | AMY32452 | Dimethyl azelaate | Dimethyl azelate, >=98.5% (GC) | Nonanedioic acid, dimethyl ester | BCP23026 | Nonane

Specifiche e purezza

≥98.5%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Purezza

≥98.5%(GC)

Nomi e identificatori

• Pubchem Sid: 504752684
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752684
• Sorrisi canonici: COC(=O)CCCCCCCC(=O)OC
• IUPAC Name: dimethyl nonanedioate
• InChIKey: DRUKNYVQGHETPO-UHFFFAOYSA-N
• INCHI: 1S/C11H20O4/c1-14-10(12)8-6-4-3-5-7-9-11(13)15-2/h3-9H2,1-2H3
• Isomeri SMILES: COC(=O)CCCCCCCC(=O)OC
• Peso molecolare: 216.28
• Reaxy-Rn: 1710125
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1710125&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty acid esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty acid methyl esters
• Alternative Parents: Dicarboxylic acids and derivatives Methyl esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty acid methyl ester - Dicarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - 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 fatty acid methyl esters. These are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail 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

• Indice di rifrazione: 1.44
• Punto di ebollizione (°C): 140 °C
• Punto di fusione (°C): 18℃
• Peso molecolare: 216.270 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 216.136 Da
• Monoisotopic Mass: 216.136 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 169.000
• 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

Domande frequenti

What is the purity of this product, and how is it determined?

This product is supplied at ≥98.5% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1732-10-1, the molecular formula is C11H20O4, and the molecular weight is 216.28 g/mol. InChIKey DRUKNYVQGHETPO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.