Metil 2,2-dietossiacetimidato - ≥95% , CAS No.76742-48-8

CAS: 76742-48-8 Cat. No.: M293819 Formula: C₇H₁₅NO₃ Peso molecolare: 161.199 Numero EC: 831-116-7

GRADE & PURITY ≥95%

Synonyms

AC6777 | DTXSID80591421 | methyl 2,2-diethoxyethanimidate | EN300-105815 | SCHEMBL557722 | 2,2-diethoxy-acetimidic acid methyl ester | AKOS015918773 | 2,2-diethoxy-ethanimidic acid methyl ester;Methyl 2,2-diethoxyacetimidate | METHYL 2,2-DIETHOXYETHANECAR

Storage

Conservare a 2-8°C

Shipped In

Ghiaccio umido

Specifications

Sinonimi

AC6777 | DTXSID80591421 | methyl 2,2-diethoxyethanimidate | EN300-105815 | SCHEMBL557722 | 2,2-diethoxy-acetimidic acid methyl ester | AKOS015918773 | 2,2-diethoxy-ethanimidic acid methyl ester;Methyl 2,2-diethoxyacetimidate | METHYL 2,2-DIETHOXYETHANECAR

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C

Spedito in

Ghiaccio umido

Purezza

≥95%

Nomi e identificatori

• Pubchem Sid: 504768659
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504768659
• Sorrisi canonici: CCOC(C(=N)OC)OCC
• IUPAC Name: methyl 2,2-diethoxyethanimidate
• InChIKey: YKOUABZEDZDJEY-UHFFFAOYSA-N
• INCHI: 1S/C7H15NO3/c1-4-10-7(11-5-2)6(8)9-3/h7-8H,4-5H2,1-3H3
• Isomeri SMILES: CCOC(C(=N)OC)OCC
• Peso molecolare: 161.199
• Reaxy-Rn: 4373019
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4373019&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboximidic acids and derivatives
      • Subclass Imidoesters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboximidic acids and derivatives
• Subclass: Imidoesters
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidoesters
• Alternative Parents: Acetals Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Imido ester - Acetal - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as imidoesters. These are organic ester derivatives of imidic acid. They have the general structure ROC(CR')=NR\", where R=organyl group, R'-R\"= H or organyl 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

• Punto di infiammabilità (°C): 50ºC
• Punto di ebollizione (°C): 159ºC at 760 mmHg
• Peso molecolare: 161.200 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 161.105 Da
• Monoisotopic Mass: 161.105 Da
• Topological Polar Surface Area: 51.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 110.000
• 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?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 76742-48-8, the molecular formula is C7H15NO3, and the molecular weight is 161.199 g/mol. InChIKey YKOUABZEDZDJEY-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.