4-Iodoaniline - ≥98% , CAS No.540-37-4

CAS: 540-37-4 Cat. No.: I107029 Formula: C₆H₆IN Peso molecolare: 219.02 Beilstein Registry Number: 774101 Numero EC: 208-743-4

GRADE & PURITY ≥98%

Synonyms

p-Aminophenyl iodide | 4-iodophenylamine | 4-Iodo-phenylamine | para-amino-iodo-benzene | 4-Iodobenzenamine | 4-iodo-benzenamine | Aniline, p-iodo- | Benzenamine, 4-iodo- | CCRIS 9122 | 0BMK56397B | NSC9246 | NSC-9246 | p-Iodoaniline | p-iodo-aniline | 4-

Storage

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

Shipped In

Wet ice

Panoramica

4-Iodoaniline is the most potent methaemoglobin former.

Specifications

Sinonimi

p-Aminophenyl iodide | 4-iodophenylamine | 4-Iodo-phenylamine | para-amino-iodo-benzene | 4-Iodobenzenamine | 4-iodo-benzenamine | Aniline, p-iodo- | Benzenamine, 4-iodo- | CCRIS 9122 | 0BMK56397B | NSC9246 | NSC-9246 | p-Iodoaniline | p-iodo-aniline | 4-

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

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

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

504752022

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752022

Sorrisi canonici

C1=CC(=CC=C1N)I

IUPAC Name

4-iodoaniline

InChIKey

VLVCDUSVTXIWGW-UHFFFAOYSA-N

INCHI

1S/C6H6IN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2

Isomeri SMILES

C1=CC(=CC=C1N)I

WGK Germania

3

RTECS

BY3850000

Peso molecolare

219.02

Beilstein

774101

Reaxy-Rn

774101

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774101&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Iodobenzenes Aryl iodides Primary amines Organopnictogen compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Iodobenzene - Halobenzene - Aryl iodide - Aryl halide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organoiodide - Organohalogen compound - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

Proprietà chimiche e fisiche

• Solubilità: Slightly soluble in water.Soluble in chloroform, methanol,diethyl ether,alcohol
• Sensibilità: Light and air sensitive
• Punto di fusione (°C): 61-63°C
• Peso molecolare: 219.020 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 218.954 Da
• Monoisotopic Mass: 218.954 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 66.900
• 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