2-Ethylhexyl iodide - ≥97% , CAS No.1653-16-3

CAS: 1653-16-3 Cat. No.: E468818 Formule: C₈H₁₇I Poids moléculaire: 240.13 Numéro CE: 216-720-5

QUALITÉ & PURETÉ ≥97%

Synonyms

Heptane, 3-(iodomethyl)-|3-(Iodomethyl)heptane|2-Ethylhexyl iodide|2-ETHYLHEXYLIODIDE|2-Ethyl-1-iodohexane|starbld0009825

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Spécifications

Synonymes

Heptane, 3-(iodomethyl)- | 3-(Iodomethyl)heptane | 2-Ethylhexyl iodide | 2-ETHYLHEXYLIODIDE | 2-Ethyl-1-iodohexane | starbld0009825

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Protected from light

Expédié en

Wet ice

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

Pureté

≥97%

Noms et identifiants

Pubchem Sid

528756255

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528756255

Sourires canoniques

CCCCC(CC)CI

IUPAC Name

3-(iodomethyl)heptane

InChIKey

WNPGSEJRPYSCDQ-UHFFFAOYSA-N

INCHI

1S/C8H17I/c1-3-5-6-8(4-2)7-9/h8H,3-7H2,1-2H3

Isomères SMILES

CCCCC(CC)CI

WGK Allemagne

3

Poids moléculaire

240.13

Reaxy-Rn

1719283

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719283&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organoiodides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organoiodides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organoiodides
• Alternative Parents: Hydrocarbon derivatives Alkyl iodides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organoiodide - Alkyl iodide - Alkyl halide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine 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

Propriétés chimiques et physiques

• Sensibilité: light & Moisture sensitive
• Indice de réfraction: 1.491
• Point d'éclair (°F): 174.2 °F
• Point d'éclair (°C): 79 °C
• Point d'ébullition (°C): 90 °C/18 mmHg
• Poids moléculaire: 240.120 g/mol
• XLogP3: 5.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 5
• Exact Mass: 240.037 Da
• Monoisotopic Mass: 240.037 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 52.500
• 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