2-Iodo-4-nitrophenol - ≥98% , CAS No.89487-91-2

CAS: 89487-91-2 Cat. No.: I349633 Formule: C₆H₄INO₃ Poids moléculaire: 265.01 Numéro CE: 624-375-0

QUALITÉ & PURETÉ ≥98%

Synonyms

4-Hydroxy-3-iodonitrobenzene | 4-hydroxy-3-iodo-nitrobenzene | 4hydroxy-3-iodo-nitrobenzene | NSC141347 | NSC-141347 | 2-iodo-4-nitrophenol | 2-Iodo-4-nitro-phenol | MFCD01165664 | SCHEMBL482237 | BKQFOYCEUMVWOW-UHFFFAOYSA-N | A843207 | 4-nitro-iodophenol

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Spécifications

Synonymes

4-Hydroxy-3-iodonitrobenzene | 4-hydroxy-3-iodo-nitrobenzene | 4hydroxy-3-iodo-nitrobenzene | NSC141347 | NSC-141347 | 2-iodo-4-nitrophenol | 2-Iodo-4-nitro-phenol | MFCD01165664 | SCHEMBL482237 | BKQFOYCEUMVWOW-UHFFFAOYSA-N | A843207 | 4-nitro-iodophenol

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Store at 2-8°C,Protected from light,Argon charged

Expédié en

Wet ice

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

Pureté

≥98%

Noms et identifiants

Pubchem Sid

508808500

Sourires canoniques

C1=CC(=C(C=C1[N+](=O)[O-])I)O

IUPAC Name

2-iodo-4-nitrophenol

InChIKey

BKQFOYCEUMVWOW-UHFFFAOYSA-N

INCHI

1S/C6H4INO3/c7-5-3-4(8(10)11)1-2-6(5)9/h1-3,9H

Isomères SMILES

C1=CC(=C(C=C1[N+](=O)[O-])I)O

Poids moléculaire

265.01

Reaxy-Rn

2519781

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2519781&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass Nitrophenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: Nitrophenols
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrophenols
• Alternative Parents: Nitrobenzenes O-iodophenols Nitroaromatic compounds Iodobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl iodides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Nitrophenol - Nitrobenzene - Nitroaromatic compound - 2-halophenol - 2-iodophenol - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Organic nitro compound - C-nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoiodide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as nitrophenols. These are compounds containing a nitrophenol moiety, which consists of a benzene ring bearing both a hydroxyl group and a nitro group on two different ring carbon atoms.
• 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 sensitive
• Point de fusion (°C): 89-94 °C
• Poids moléculaire: 265.010 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 264.924 Da
• Monoisotopic Mass: 264.924 Da
• Topological Polar Surface Area: 66.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 158.000
• 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