1-Chloro-6-iodohexane - ≥98% , CAS No.34683-73-3

CAS: 34683-73-3 Cat. No.: C153665 Molecular Weight: 246.52 EC Number: 252-144-0

GRADE & PURITY ≥98%

Synonyms

C6H12ClI | AKOS015912780 | C2714 | MFCD00039417 | FT-0607638 | J-019711 | Hexamethylene chloroiodide | 1-Chloro-6-iodohexane, 96% | 6-chloro-1-iodohexane | EINECS 252-144-0 | 1-Chloro-6-iodohexane (stabilized with Copper chip) | 1-Chloro-6-iodohexane | 1-

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

Usually used in the preparation of 1,14-dichloro-7-tetradecyne[2] and 10-2′-(methylphenyl)-7-decynyl chloride.

Specifications

Synonyms

C6H12ClI | AKOS015912780 | C2714 | MFCD00039417 | FT-0607638 | J-019711 | Hexamethylene chloroiodide | 1-Chloro-6-iodohexane, 96% | 6-chloro-1-iodohexane | EINECS 252-144-0 | 1-Chloro-6-iodohexane (stabilized with Copper chip) | 1-Chloro-6-iodohexane | 1-

Specifications & Purity

≥98%

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504756795
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756795
• Canonical Smiles: C(CCCI)CCCl
• IUPAC Name: 1-chloro-6-iodohexane
• InChIKey: QTJHNJCILMMRIQ-UHFFFAOYSA-N
• INCHI: 1S/C6H12ClI/c7-5-3-1-2-4-6-8/h1-6H2
• Isomeric SMILES: C(CCCI)CCCl
• WGK Germany: 3
• Molecular Weight: 246.52
• Reaxy-Rn: 1732408
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732408&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Class Organoiodides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: Organoiodides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organoiodides
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl iodides Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organoiodide - Organochloride - Alkyl iodide - Alkyl halide - Alkyl chloride - 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

Chemical and Physical Properties

• Solubility: Not miscible in water.
• Sensitivity: light sensitive&air sensitive
• Refractive Index: 1.5230
• Flash Point(°C): 103 °C
• Boil Point(°C): 92 °C/4 mmHg
• Molecular Weight: 246.520 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 5
• Exact Mass: 245.967 Da
• Monoisotopic Mass: 245.967 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 39.500
• 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