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(2-Acetyl-4-Methylpentyl)trimethylammonium Iodide is a chemical compound that is identified as an impurity in Tetrabenazine (T284000), which is an antipsychotic medication. (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide is characterized by its unique molecular structure and properties, which may have implications for its behavior and potential applications in various fields.

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  • 1069-62-1 Structure
  • Basic information

    1. Product Name: (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide
    2. Synonyms: (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide;2-acetyl-N,N,N,4-tetraMethylpentan-1-aMiniuM iodide;3-((dimethylamino)methyl)-5-methylhexan-2-one methiodide
    3. CAS NO:1069-62-1
    4. Molecular Formula: C11H24NO*I
    5. Molecular Weight: 313.21883
    6. EINECS: N/A
    7. Product Categories: Aliphatics;Amines;Impurities;Intermediates & Fine Chemicals;Pharmaceuticals;Amines, Aliphatics, Impurities, Pharmaceuticals, Intermediates & Fine Chemicals
    8. Mol File: 1069-62-1.mol
  • Chemical Properties

    1. Melting Point: 180-181 °C
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
    8. Solubility: DMSO (Slightly), Methanol (Slightly, Heated)
    9. CAS DataBase Reference: (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide(CAS DataBase Reference)
    10. NIST Chemistry Reference: (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide(1069-62-1)
    11. EPA Substance Registry System: (2-Acetyl-4-Methylpentyl)triMethylaMMoniuM Iodide(1069-62-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1069-62-1(Hazardous Substances Data)

1069-62-1 Usage

Uses

Used in Pharmaceutical Industry:
(2-Acetyl-4-Methylpentyl)trimethylammonium Iodide is used as an impurity in the production of Tetrabenazine (T284000), an antipsychotic medication. Its presence in the drug may affect the overall efficacy, safety, and pharmacological profile of the medication. As a result, it is crucial to monitor and control the levels of this impurity during the manufacturing process to ensure the quality and effectiveness of the final product.
In the context of its use as an impurity in Tetrabenazine, the compound may have potential implications for the drug's pharmacological actions, side effects, and overall therapeutic profile. Further research and investigation may be necessary to fully understand the role and impact of (2-Acetyl-4-Methylpentyl)trimethylammonium Iodide in the context of antipsychotic medications and their use in treating various psychiatric disorders.

Check Digit Verification of cas no

The CAS Registry Mumber 1069-62-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,0,6 and 9 respectively; the second part has 2 digits, 6 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1069-62:
(6*1)+(5*0)+(4*6)+(3*9)+(2*6)+(1*2)=71
71 % 10 = 1
So 1069-62-1 is a valid CAS Registry Number.

1069-62-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-((dimethylamino)methyl)-5-methylhexan-2-one methiodide

1.2 Other means of identification

Product number -
Other names 3-dimethylaminomethyl-5-methyl-hexan-2-one methiodide

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1069-62-1 SDS

1069-62-1Relevant articles and documents

Real-Time Monitoring of Solid-Liquid Slurries: Optimized Synthesis of Tetrabenazine

Sato, Yusuke,Liu, Junliang,Kukor, Andrew J.,Culhane, Jeffrey C.,Tucker, John L.,Kucera, David J.,Cochran, Brian M.,Hein, Jason E.

, p. 14069 - 14078 (2021)

Solid-liquid slurries are vital and increasingly prevalent in the pharmaceutical and chemical industries. Despite the importance of these heterogeneous systems, process control and optimization are fundamentally hindered by a lack of compatible real-time analytical techniques. We present herein an online HPLC monitoring platform enabling access to real-time compositional information on slurries. We demonstrate the system by investigating the heterogeneous synthesis reaction of tetrabenazine. Furthermore, we integrated our online HPLC platform with the orthogonal monitoring techniques of a pH probe and a microscopic imaging probe to provide additional mechanistic insight. These combined insights enable the optimization of tetrabenazine synthesis in terms of reaction time, byproduct formation, and diastereomeric purity of the final product.

The synthesis of precursor of FP- (+) DTBZ

Wu, Caijiao,Li, Hui,Sun, Feiyang,Bao, Changshun,Bao, Xuefei,Chen, Guoliang

supporting information, p. 3218 - 3225 (2019/09/13)

A synthetic route to the precursor of FP- (+) DTBZ was disclosed, in which 3-hydroxy-4-methoxybenzaldehyde was employed as a starting material. In the method, the benzyl-protecting protocol and the in-situ Diels-Alder reaction made the procedure more practical because of the mild conditions for selectively deprotection and the accelerated reaction process.

BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2

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Paragraph 0230; 0231; 0243; 0244, (2018/07/05)

The present invention relates to new benzoquinoline inhibitors of vesicular monoamine transporter 2 (VMAT2), pharmaceutical compositions thereof, and methods of use thereof.

ANALOGS OF DEUTETRABENAZINE, THEIR PREPARATION AND USE

-

Page/Page column 26, (2018/10/19)

The disclosure is directed to deutetrabenazine analogs, compositions comprising same and methods of detecting same in compositions comprising deutetrabenazine.

BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2

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Paragraph 00173, (2015/06/08)

The present invention relates to new benzoquinoline inhibitors of vesicular monoamine transporter 2 (VMAT2), pharmaceutical compositions thereof, and methods of use thereof. (I)

BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2

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Paragraph 00199, (2015/08/06)

The present invention relates to new benzoquinoline inhibitors of vesicular monoamine transporter 2 (VMAT2), pharmaceutical compositions thereof, and methods of use thereof. (Formula (I))

METHODS OF TREATING ABNORMAL MUSCULAR ACTIVITY

-

Paragraph 0205, (2015/06/08)

Methods for treating abnormal muscular activity are disclosed. The methods may be performed remotely and permit monitoring of a subject outside a healthcare provider's office.

METHODS OF MANUFACTURING BENZOQUINOLINE COMPOUNDS

-

Paragraph 0237; 0238, (2015/06/10)

The present invention relates to new methods of manufacturing benzoquinoline inhibitors of vesicular monoamine transporter 2 (VMAT2), and intermediates thereof.

PROCESS FOR PREPARING TETRABENAZINE

-

Page/Page column 27, (2012/06/30)

A substantially pure crystalline form A of tetrabenazine compound of structural formula I and processes for the preparation thereof is provided.

BENZOQUINOLONE INHIBITORS OF VMAT2

-

Page/Page column 49, (2011/12/14)

The present invention relates to new benzoquinolone inhibitors of VMAT2, pharmaceutical compositions thereof, and methods of use thereof. Formula (I)

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