4-Amino-2-iodophenol - ≥95%(HPLC) , CAS No.89640-51-7

CAS: 89640-51-7 Cat. No.: A464039 Peso molecular: 235.03 Número EC: 694-409-7

GRADE & PURITY ≥95%(HPLC)

Synonyms

MFCD06656564 | SCHEMBL1628474 | DTXSID10549051 | EN300-1272192 | AKOS015150482 | GUGSDWSSHLBVST-UHFFFAOYSA-N | 4-Amino-2-iodophenol, >=95.0% (HPLC) | D84192 | FT-0677587 | AM20041350 | 3-Iodo-4-hydroxyaniline | 4-HYDROXY-3-IODOANILINE | 4-hydroxy-3-iodo-a

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

MFCD06656564 | SCHEMBL1628474 | DTXSID10549051 | EN300-1272192 | AKOS015150482 | GUGSDWSSHLBVST-UHFFFAOYSA-N | 4-Amino-2-iodophenol, >=95.0% (HPLC) | D84192 | FT-0677587 | AM20041350 | 3-Iodo-4-hydroxyaniline | 4-HYDROXY-3-IODOANILINE | 4-hydroxy-3-iodo-a

Especificaciones y pureza

≥95%(HPLC)

Condiciones de almacenamiento de almacenamiento

Protected from light, Argon charged, Room temperature

Enviado en

Normal

Pureza

≥95%(HPLC)

Nombres e identificadores

• Pubchem Sid: 504767495
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767495
• Sonrisas canónicas: C1=CC(=C(C=C1N)I)O
• IUPAC Name: 4-amino-2-iodophenol
• InChIKey: GUGSDWSSHLBVST-UHFFFAOYSA-N
• INCHI: 1S/C6H6INO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H,8H2
• Isómeros SMILES: C1=CC(=C(C=C1N)I)O
• Peso molecular: 235.03
• Reaxy-Rn: 2716290
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2716290&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenols
      • Subclass Halophenols
        • Level5 Iodophenols
          • Level6 O-iodophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenols
• Subclass: Halophenols
• Intermediate Tree Nodes: Iodophenols
• Direct Parent: O-iodophenols
• Alternative Parents: p-Aminophenols Aniline and substituted anilines Iodobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl iodides Primary amines Organopnictogen compounds Organooxygen compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenol - P-aminophenol - Aniline or substituted anilines - 2-iodophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Amine - Organoiodide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as o-iodophenols. These are iodophenols carrying a iodine at the C2 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

Propiedades químicas y físicas

• Sensibilidad: air sensitive；light sensitive
• Punto de fusión (°C): 110-120 °C
• Peso molecular: 235.020 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 234.949 Da
• Monoisotopic Mass: 234.949 Da
• Topological Polar Surface Area: 46.300 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