3-Methylhexane - ≥95%(GC) , CAS No.589-34-4

CAS: 589-34-4 Cat. No.: M158521 Fórmula: C₇H₁₆ Peso molecular: 100.21 Beilstein Registry Number: 1718740 Número EC: 209-643-3

CALIDAD & PUREZA ≥95%(GC)

Synonyms

(S)-(+)-3-methylhexane | AKOS015841881 | DTXSID3044334 | (+/-)-3-METHYLHEXANE | 3-Methylhexane, 99% | 3-Methylhexane; (+/-)-3-Methylhexane; 2-Ethylpentane; NSC 73937 | EINECS 209-643-3 | 1J3ZK6L6VY | Hexane, 3-methyl- | NCGC00260396-01 | NSC73937 | NSC-73

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Especificaciones

Sinónimos

(S)-(+)-3-methylhexane | AKOS015841881 | DTXSID3044334 | (+/-)-3-METHYLHEXANE | 3-Methylhexane, 99% | 3-Methylhexane; (+/-)-3-Methylhexane; 2-Ethylpentane; NSC 73937 | EINECS 209-643-3 | 1J3ZK6L6VY | Hexane, 3-methyl- | NCGC00260396-01 | NSC73937 | NSC-73

Especificaciones y pureza

≥95%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice,FedEx DG Service

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

Pureza

≥95%(GC)

Nombres e identificadores

Pubchem Sid

504752142

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752142

Sonrisas canónicas

CCCC(C)CC

IUPAC Name

3-methylhexane

InChIKey

VLJXXKKOSFGPHI-UHFFFAOYSA-N

INCHI

1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3

Isómeros SMILES

CCCC(C)CC

WGK Alemania

2

Número ONU

1206

Grupo de embalaje

II

Peso molecular

100.21

Beilstein

1718740

Reaxy-Rn

1718740

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1718740&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Clase Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Clase: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched alkane - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as branched alkanes. These are acyclic branched hydrocarbons having the general formula CnH2n+2.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Hygroscopic
• Índice de refracción: 1.39
• Punto de inflamación (°F): 30.2 °F
• Punto de inflamación (°C): -1°C
• Punto de ebullición (°C): 91 °C
• Punto de fusión (°C): -119°C
• Peso molecular: 100.200 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 100.125 Da
• Monoisotopic Mass: 100.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 31.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1