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(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate is a complex chemical compound consisting of two distinct components. The first component, (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one, is a benzodiazepine derivative that may exhibit psychoactive properties. The second component, (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate, is a succinate derivative involved in the Krebs cycle. This unique combination of components endows the molecule with potential applications in the pharmaceutical industry and organic synthesis.

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  • (S)-1-amino-3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-methylbenzoyloxy)succinate

    Cas No: 425386-58-9

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  • (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate

    Cas No: 425386-58-9

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  • 425386-58-9 Structure
  • Basic information

    1. Product Name: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate
    2. Synonyms: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate;(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate-2
    3. CAS NO:425386-58-9
    4. Molecular Formula: C31H32N2O9
    5. Molecular Weight: 576.59378
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 425386-58-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate(CAS DataBase Reference)
    10. NIST Chemistry Reference: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate(425386-58-9)
    11. EPA Substance Registry System: (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate(425386-58-9)
  • 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: 425386-58-9(Hazardous Substances Data)

425386-58-9 Usage

Uses

Used in Pharmaceutical Industry:
(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate is used as an active pharmaceutical ingredient for the development of new drugs. The benzodiazepine derivative component may contribute to its psychoactive properties, making it a candidate for the treatment of various neurological and psychiatric disorders.
Used in Organic Synthesis:
In the field of organic synthesis, (S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate serves as a key intermediate or building block for the synthesis of more complex molecules. Its unique structure allows for further functionalization and modification, leading to the creation of novel compounds with diverse applications in various industries.
Used in Drug Delivery Systems:
(S)-1-aMino-3-Methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one (2R,3R)-2,3-bis(4-Methylbenzoyloxy)succinate can be utilized in the development of innovative drug delivery systems. Its structural features may facilitate the design of targeted drug carriers, enhancing the bioavailability and therapeutic efficacy of associated pharmaceuticals.
Used in Research and Development:
This complex molecule is also valuable in research and development settings, where it can be studied to better understand the interactions between different molecular components and their effects on biological systems. Such insights can lead to the discovery of new therapeutic targets and the development of more effective treatments for various diseases.

Check Digit Verification of cas no

The CAS Registry Mumber 425386-58-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 4,2,5,3,8 and 6 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 425386-58:
(8*4)+(7*2)+(6*5)+(5*3)+(4*8)+(3*6)+(2*5)+(1*8)=159
159 % 10 = 9
So 425386-58-9 is a valid CAS Registry Number.

425386-58-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name (5S)-5-amino-3-methyl-2,5-dihydro-1H-3-benzazepin-4-one,(2R,3R)-2,3-bis[(4-methylbenzoyl)oxy]butanedioic acid

1.2 Other means of identification

Product number -
Other names (S)-1-amino-3-methyl-4,5-dihydro-1H-benzo[d]azepin-2(3H)-one(2R,3R)-2,3-bis(4-methylbenzoyloxy)succinate

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:425386-58-9 SDS

425386-58-9Downstream Products

425386-58-9Relevant articles and documents

Classical and dynamic resolution of 1-amino-3-methyl-1,3,4,5- tetrahydrobenzo[d]azepin-2-one

Mitchell, David,Hay, Lynne A.,Koenig, Thomas M.,McDaniel, Stacey,Nissen, Jeffrey S.,Audia, James E.

, p. 3814 - 3819 (2007/10/03)

Two efficient production processes of enantioenriched 1-amino-3-methyl-1,3, 4,5-tetrahydro-benzo[d]azepin-2-one 1 were achieved using the readily available starting materials. A key step in the methodologies is a classical resolution or a dynamic resolution that provides excellent chemical (>80%) yields and enantiomeric excesses (>99.8% ee). The classical resolution was developed on a preparative scale while the dynamic resolution was implemented on a pilot plant scale.

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