2-Ethylacryloyl chloride - ≥90%, contains 150ppm BHT as inhibitor , CAS No.4390-96-9

CAS: 4390-96-9 Cat. No.: E477289 Formule: C₂H₅C(=CH₂)COCl Poids moléculaire: 118.56 Numéro CE: 630-593-7

GRADE & PURITY ≥90%, contains 150ppm BHT as inhibitor

Synonyms

2-Ethylacryloyl chloride | 2-methylidenebutanoyl Chloride | 2-ETHYLACRYLOYL CHLORIDE99 | AKOS015894274 | 2-Ethylacryloyl chloride, contains 150 ppm BHT as inhibitor, 90% | Butanoyl chloride,2-methylene- | SCHEMBL599206 | 2-Methylenebutanoyl chloride | EN3

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Vue d’ensemble

Description

Acid chloride is a building block for organic synthesis.

Specifications

Synonymes

2-Ethylacryloyl chloride | 2-methylidenebutanoyl Chloride | 2-ETHYLACRYLOYL CHLORIDE99 | AKOS015894274 | 2-Ethylacryloyl chloride, contains 150 ppm BHT as inhibitor, 90% | Butanoyl chloride,2-methylene- | SCHEMBL599206 | 2-Methylenebutanoyl chloride | EN3

Spécifications et pureté

≥90%, contains 150ppm BHT as inhibitor

Conditions de stockage de stockage

Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥90%

Noms et identifiants

• Sourires canoniques: CCC(=C)C(=O)Cl
• IUPAC Name: 2-methylidenebutanoyl chloride
• InChIKey: IIYDTSAAECYHAE-UHFFFAOYSA-N
• INCHI: 1S/C5H7ClO/c1-3-4(2)5(6)7/h2-3H2,1H3
• Isomères SMILES: CCC(=C)C(=O)Cl
• Numéro ONU: 2924
• Poids moléculaire: 118.56
• Reaxy-Rn: 1740931
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740931&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Acyl halides
      • Subclass Acyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Acyl halides
• Subclass: Acyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl chlorides
• Alternative Parents: Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acyl chlorides. These are organic compounds containing the functional group -CO-Cl.
• 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

• Indice de réfraction: n20/D 1.444 (lit.)
• Point d'éclair (°F): 62.6 °F
• Point d'éclair (°C): 17 °C
• Point d'ébullition (°C): 118-126℃ (lit.)
• Poids moléculaire: 118.560 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 118.019 Da
• Monoisotopic Mass: 118.019 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 96.300
• 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