2,6-Dichloro-4-iodophenol - ≥98% , CAS No.34074-22-1

CAS: 34074-22-1 Cat. No.: D192839 Summenformel: C₆H₃Cl₂IO Molekulargewicht: 288.9

GRADE & PURITY ≥98%

Synonyms

AB93099 | SCHEMBL2036976 | DTXSID20403711 | FT-0723074 | 2,6-dichloro-4-iodophenol | TD1374 | AKOS016005751 | A875112 | C6H3Cl2IO | SY034448 | MFCD00466446 | AC-28482 | AIGWECICLKWOIR-UHFFFAOYSA-N | DS-15931 | Phenol, 2,6-dichloro-4-iodo-

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

AB93099 | SCHEMBL2036976 | DTXSID20403711 | FT-0723074 | 2,6-dichloro-4-iodophenol | TD1374 | AKOS016005751 | A875112 | C6H3Cl2IO | SY034448 | MFCD00466446 | AC-28482 | AIGWECICLKWOIR-UHFFFAOYSA-N | DS-15931 | Phenol, 2,6-dichloro-4-iodo-

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504763039

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504763039

Kanonisches Lächeln

C1=C(C=C(C(=C1Cl)O)Cl)I

IUPAC Name

2,6-dichloro-4-iodophenol

InChIKey

AIGWECICLKWOIR-UHFFFAOYSA-N

INCHI

1S/C6H3Cl2IO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H

Isomere SMILES

C1=C(C=C(C(=C1Cl)O)Cl)I

Molekulargewicht

288.9

Reaxy-Rn

2046858

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2046858&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Ebene5 Chlorobenzenes
          • Ebene6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: P-iodophenols O-chlorophenols Iodobenzenes Aryl iodides Aryl chlorides Organooxygen compounds Organoiodides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 1,3-dichlorobenzene - 4-halophenol - 2-halophenol - 2-chlorophenol - 4-iodophenol - Iodobenzene - Phenol - Aryl iodide - Aryl halide - Aryl chloride - Organoiodide - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 288.890 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 287.861 Da
• Monoisotopic Mass: 287.861 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 110.000
• 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