Ethyl 2,4-dimethylthiazole-5-carboxylate - ≥95% , CAS No.7210-77-7

CAS: 7210-77-7 Cat. No.: E139218 Formule: C₈H₁₁NO₂S Poids moléculaire: 185.24 Numéro CE: 156-394-0

GRADE & PURITY ≥95%

Synonyms

AKOS002350028 | Ethyl 2,4-dimethylthiazole-5-carboxylate, 97% | 2,4-Dimethyl-thiazole-5-carboxylic acid ethyl ester | BB 0238153 | PD021458 | Z48850645 | AKOS015951212 | TS-02581 | Eljon Fast Scarlet PV Extra | EN300-64325 | ethyl 2,4-dimethylthiazole-5-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

AKOS002350028 | Ethyl 2,4-dimethylthiazole-5-carboxylate, 97% | 2,4-Dimethyl-thiazole-5-carboxylic acid ethyl ester | BB 0238153 | PD021458 | Z48850645 | AKOS015951212 | TS-02581 | Eljon Fast Scarlet PV Extra | EN300-64325 | ethyl 2,4-dimethylthiazole-5-

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥95%

Noms et identifiants

• Pubchem Sid: 504759483
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759483
• Sourires canoniques: CCOC(=O)C1=C(N=C(S1)C)C
• IUPAC Name: ethyl 2,4-dimethyl-1,3-thiazole-5-carboxylate
• InChIKey: BXOIIRQIGYJTTB-UHFFFAOYSA-N
• INCHI: 1S/C8H11NO2S/c1-4-11-8(10)7-5(2)9-6(3)12-7/h4H2,1-3H3
• Isomères SMILES: CCOC(=O)C1=C(N=C(S1)C)C
• WGK Allemagne: 3
• Poids moléculaire: 185.24
• Reaxy-Rn: 132466
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=132466&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Azoles
      • Subclass Thiazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azoles
• Subclass: Thiazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiazolecarboxylic acids and derivatives
• Alternative Parents: 2,4,5-trisubstituted thiazoles Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Thiazolecarboxylic acid or derivatives - 2,4,5-trisubstituted 1,3-thiazole - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as thiazolecarboxylic acids and derivatives. These are heterocyclic compounds containing a thiazole ring which bears a carboxylic acid group (or a derivative thereof).
• 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

Propriétés chimiques et physiques

• Point d'éclair (°F): >230 °F
• Point d'éclair (°C): >110 °C
• Point de fusion (°C): 46-50 °C
• Poids moléculaire: 185.250 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 185.051 Da
• Monoisotopic Mass: 185.051 Da
• Topological Polar Surface Area: 67.400 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 174.000
• 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

Foire aux questions

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 room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 7210-77-7, the molecular formula is C8H11NO2S, and the molecular weight is 185.24 g/mol. InChIKey BXOIIRQIGYJTTB-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.