2-CHLORO-2,3-DIMETHYL BUTANE - ≥95% , CAS No.594-57-0

CAS: 594-57-0 Cat. No.: C304093 Peso molecular: 120.62

GRADE & PURITY ≥95%

Synonyms

2-Chloro-2,3-dimethylbutane|594-57-0|2-Chloro-2,3-dimethyl butane|Butane, 2-chloro-2,3-dimethyl-|SCHEMBL756149|2-chloro-2,3-dimethyl-butane|2-Chloro-2,3-dimethylbutane #|HEMQRALQJLCVBR-UHFFFAOYSA-|DTXSID40208124|MFCD00061030|AKOS006273262|GS-6129|FT-06916

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

2-Chloro-2, 3-dimethylbutane | 594-57-0 | 2-Chloro-2, 3-dimethyl butane | Butane, 2-chloro-2, 3-dimethyl- | SCHEMBL756149 | 2-chloro-2, 3-dimethyl-butane | 2-Chloro-2, 3-dimethylbutane # | HEMQRALQJLCVBR-UHFFFAOYSA- | DTXSID40208124 | MFCD00061030 | AKOS006273262 | GS-6129 | FT-06916

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(C)C(C)(C)Cl
• IUPAC Name: 2-chloro-2,3-dimethylbutane
• InChIKey: HEMQRALQJLCVBR-UHFFFAOYSA-N
• INCHI: 1S/C6H13Cl/c1-5(2)6(3,4)7/h5H,1-4H3
• Isómeros SMILES: CC(C)C(C)(C)Cl
• Peso molecular: 120.62
• Reaxy-Rn: 1731444
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731444&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
• 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

Propiedades químicas y físicas

• Punto de ebullición (°C): 112.05°C
• Punto de fusión (°C): -10.4°C
• Peso molecular: 120.620 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 120.071 Da
• Monoisotopic Mass: 120.071 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 55.200
• 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