2-Iodo-5-methylaniline - ≥98% , CAS No.13194-69-9

CAS: 13194-69-9 Cat. No.: I181158 Formula: C₇H₈IN Peso molecolare: 233.05 Numero EC: 802-766-9

QUALITÀ & PUREZZA ≥98%

Synonyms

MFCD00833395 | CL8399 | (2-iodo-5-methylphenyl)amine | 3-Amino-4-iodotoluene | EN300-210080 | A2781 | SCHEMBL792455 | DTXSID10371511 | Benzenamine, 2-iodo-5-methyl- | 2-iodo-5-methylphenylamine | 2-Iodo-5-methylaniline | AC-3698 | AKOS005215996 | 2-Jod- 5

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifiche

Sinonimi

MFCD00833395 | CL8399 | (2-iodo-5-methylphenyl)amine | 3-Amino-4-iodotoluene | EN300-210080 | A2781 | SCHEMBL792455 | DTXSID10371511 | Benzenamine, 2-iodo-5-methyl- | 2-iodo-5-methylphenylamine | 2-Iodo-5-methylaniline | AC-3698 | AKOS005215996 | 2-Jod- 5

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at 2-8°C

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

504761323

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504761323

Sorrisi canonici

CC1=CC(=C(C=C1)I)N

IUPAC Name

2-iodo-5-methylaniline

InChIKey

KXPBTNCFONSVIA-UHFFFAOYSA-N

INCHI

1S/C7H8IN/c1-5-2-3-6(8)7(9)4-5/h2-4H,9H2,1H3

Isomeri SMILES

CC1=CC(=C(C=C1)I)N

Peso molecolare

233.05

Reaxy-Rn

2828199

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2828199&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Toluenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminotoluenes
• Alternative Parents: Aniline and substituted anilines Iodobenzenes Aryl iodides Primary amines Organopnictogen compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminotoluene - 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 aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
• 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

• Punto di infiammabilità (°C): 115 °C
• Punto di fusione (°C): 36 °C
• Peso molecolare: 233.050 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 232.97 Da
• Monoisotopic Mass: 232.97 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 94.900
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 13194-69-9, the molecular formula is C7H8IN, and the molecular weight is 233.05 g/mol. InChIKey KXPBTNCFONSVIA-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.