CAS 4165-61-1

Benzen-2,3,4,5,6-d5-amine

Description:

Benzen-2,3,4,5,6-d5-amine, also known as deuterated aniline, is an isotopically labeled derivative of aniline where five hydrogen atoms are replaced by deuterium, a stable isotope of hydrogen. This compound retains the fundamental characteristics of aniline, which is an aromatic amine with a benzene ring attached to an amino group (-NH2). The presence of deuterium alters certain physical properties, such as boiling and melting points, due to the increased mass. Benzen-2,3,4,5,6-d5-amine is typically used in research applications, particularly in studies involving NMR spectroscopy, where the deuterium label can provide insights into molecular dynamics and interactions. It is also utilized in the synthesis of various chemical compounds and in the development of pharmaceuticals. As with other amines, it may exhibit basic properties and can participate in various chemical reactions, including electrophilic aromatic substitution and nucleophilic reactions. Safety precautions should be observed when handling this compound, as it may pose health risks similar to those associated with non-deuterated aniline.

Formula: C₆H₂D₅N

InChI: InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2/i1D,2D,3D,4D,5D

InChI key: InChIKey=PAYRUJLWNCNPSJ-RALIUCGRSA-N

SMILES: NC1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H]

Synonyms:

• (2,3,4,5,6-2H5)Aniline
• (~2~H_5_)aniline
• 2,3,4,5,6-Pentadeuterioaniline
• 2,3,4,5,6-Pentadeuteroaniline
• Aniline-2,3,4,5,6-d₅
• Aniline-d₅
• Benzen-2,3,4,5,6-d₅-amine
• Benzen-d5-amine
• Benzen-d₅-amine
• Phenyl-d5-amine
• Phenyl-d₅ amine
• Benzen-2,3,4,5,6-d5-amine

Aniline-2',3',4',5',6'-D5 >98 Atom % D 5ml ampoule

CAS: 4165-61-1

Aniline-2',3',4',5',6'-D5 >98 Atom % D 5ml ampoule

Formula: C₆H₂D₅N

Purity: >98 Atom % D

Color and Shape: Liquid

Molecular weight: 98.15728

Ref: 54-DE730A

Aniline-2',3',4',5',6'-D5 >98 Atom % D 1ml ampoule

CAS: 4165-61-1

Aniline-2',3',4',5',6'-D5 >98 Atom % D 1ml ampoule

Formula: C₆H₂D₅N

Purity: >98 Atom % D

Color and Shape: Liquid

Molecular weight: 98.15728

Ref: 54-DE730

Aniline-2,3,4,5,6-d5

CAS: 4165-61-1, 62-53-3

Formula: C₆D₅NH₂

Purity: 99 atom % D

Color and Shape: Colourless To Brown Oily Liquid

Molecular weight: 98.08923

Ref: 3U-D2039

Aniline D5 2000 µg/mL in Methyl-tert-butyl ether

Controlled Product

CAS: 4165-61-1

Formula: C₆H₅H₂N

Color and Shape: Single Solution

Molecular weight: 98.16

Ref: 04-YA10262600MB

Aniline D5

Controlled Product

CAS: 4165-61-1

Formula: C₆H₅H₂N

Color and Shape: Neat

Molecular weight: 98.16

Ref: 04-C10262600

Aniline-D5

CAS: 4165-61-1

Aniline-d5 is a deuterated isotope marker of Aniline, which can be used for isotope tracing.Aniline induces toxicity to the spleen through iron overload.

Formula: C₆H₇N

Purity: 98.92%

Color and Shape: Transparent Liquid

Molecular weight: 98.16

Ref: TM-TMIJ-0342

Aniline-d5

Controlled Product

CAS: 4165-61-1

Stability Air Sensitive, Material darkens in storage with no loss in purity
Applications Isotope labelled Aniline (A662475), which is used in the manufacture of dyes, medicinals, resins, varnishes, perfumes, as a vulcanizing rubber or even as a solvent (1,2). Hazardous and noxious substance which affects the early life stages of marine animals (3). Drinking water contaminant candidate list 3 (CCL 3) compound as per United States Environmental Protection Agency (EPA), environmental, and food contaminants. Dyes and metabolites, Environmental Testing
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References 1. Cunha, I. et. al.: Environ. Sci. Pollut. Res. Int. 2017 Mar 10.2. Zhang, X. et al.: Synthesis. 2013 45(10): 1357-13633. Barkov, A. et al.: Russ. Chem. Bull. 2012. Aug:61(8) pp1564-9

Formula: C₆₂H₅H₂N

Color and Shape: Neat

Molecular weight: 98.16

Ref: TR-A662477

Aniline-d5 in Dichloromethane

CAS: 4165-61-1

Dichloromethane

Ref: BE-BePure-20368YD-2000

Aniline-d5 in Toluene

CAS: 4165-61-1

Toluene

Ref: BE-BePure-20368YT-2000

Aniline D5 in Methanol

CAS: 4165-61-1

Methanol

Ref: BE-BePure-20368XM-100

Aniline-d5 in Toluene

CAS: 4165-61-1

Toluene

Ref: BE-BePure-20368XT-100

Aniline D5

Controlled Product

CAS: 4165-61-1

Aniline D5 is a metabolic probe used to study the activation of carcinogens. Aniline D5 inhibits the growth of cancer cells by binding to amines, which are present in epidermal growth factor and other growth factors. When an anhydrous sodium hydrogen bond forms between the amines and the aniline, it causes a frequency shift in the aromatic ring that leads to a change in its physical properties. This change can be detected using high-resolution NMR spectroscopy. The sensitivity of this technique has been improved by adding activated charcoal as a matrix effect.

Formula: C₆H₂D₅N

Purity: Min. 95%

Molecular weight: 98.15 g/mol

Ref: 3D-FA146240

Aniline-d5

CAS: 4165-61-1

Formula: C₆H₂D₅N

Molecular weight: 98

Ref: ST-EA-CP-IL0061

ANILINE-D5

CAS: 4165-61-1

Formula: C₆H₇N

Purity: 95.0%

Color and Shape: Liquid

Molecular weight: 98.16

Ref: 10-F512907