4-Chloro-3-iodophenol - ≥97% , CAS No.202982-72-7

CAS: 202982-72-7 Cat. No.: C168376 Formule: C₆H₄ClIO Poids moléculaire: 254.45 Numéro CE: 606-512-6

QUALITÉ & PURETÉ ≥97%

Synonyms

4-Chloro-3-iodophenol | 4-chloro-3-iodo-phenol | Phenol, 4-chloro-3-iodo- | PS-7425 | A856754 | DTXSID10628976 | UPIATGHEVZKVRT-UHFFFAOYSA-N | FT-0687043 | MFCD00070769 | EN300-125657 | 4-Chloro-3-iodophenol, 97% | SCHEMBL322462 | AKOS016005756

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

4-Chloro-3-iodophenol | 4-chloro-3-iodo-phenol | Phenol, 4-chloro-3-iodo- | PS-7425 | A856754 | DTXSID10628976 | UPIATGHEVZKVRT-UHFFFAOYSA-N | FT-0687043 | MFCD00070769 | EN300-125657 | 4-Chloro-3-iodophenol, 97% | SCHEMBL322462 | AKOS016005756

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

Sourires canoniques

C1=CC(=C(C=C1O)I)Cl

IUPAC Name

4-chloro-3-iodophenol

InChIKey

UPIATGHEVZKVRT-UHFFFAOYSA-N

INCHI

1S/C6H4ClIO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H

Isomères SMILES

C1=CC(=C(C=C1O)I)Cl

Poids moléculaire

254.45

Reaxy-Rn

3236478

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3236478&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass Halophenols
        • Level5 Chlorophenols
          • Level6 P-chlorophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Chlorophenols
• Direct Parent: P-chlorophenols
• Alternative Parents: M-iodophenols Iodobenzenes Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl iodides Aryl chlorides Organooxygen compounds Organoiodides Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 4-chlorophenol - 3-iodophenol - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Halobenzene - Iodobenzene - Aryl chloride - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organoiodide - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as p-chlorophenols. These are chlorophenols carrying a iodine at the C4 position of the benzene ring.
• 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

• Poids moléculaire: 254.450 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 253.9 Da
• Monoisotopic Mass: 253.9 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 99.100
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 202982-72-7, the molecular formula is C6H4ClIO, and the molecular weight is 254.45 g/mol. InChIKey UPIATGHEVZKVRT-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.