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CAS

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184705-03-1

METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE is a chemical compound belonging to the class of indole derivatives. It is a methyl ester derivative of 5-hydroxytryptamine, a neurotransmitter that plays a crucial role in mood regulation and behavior. METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE's unique structural features make it a promising candidate for pharmaceutical applications, particularly in the development of medications for mood disorders, anxiety, and depression.

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  • 1H-Indole-3-carboxylic acid, 2-ethyl-5-hydroxy-1-(phenylmethyl)-, methyl ester

    Cas No: 184705-03-1

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  • 184705-03-1 Structure

  • Basic information

    1. Product Name: METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE
    2. Synonyms: METHYL 1-BENZYL-2-ETHYL-5-HYDROXYINDOLE-3-CARBOXYLATE;1H-Indole-3-carboxylic acid,2-ethyl-5-hydroxy-1-(phenylMethyl)-,Methyl ester;BUTTPARK 92\50-100;METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE
    3. CAS NO:184705-03-1
    4. Molecular Formula: C19H19NO3
    5. Molecular Weight: 309.36
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 184705-03-1.mol

  • Chemical Properties

    1. Melting Point: 199-200
    2. Boiling Point: 528.7°Cat760mmHg
    3. Flash Point: 273.5°C
    4. Appearance: /
    5. Density: 1.17g/cm3
    6. Vapor Pressure: 8.57E-12mmHg at 25°C
    7. Refractive Index: 1.593
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 9.28±0.40(Predicted)
    11. CAS DataBase Reference: METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE(CAS DataBase Reference)
    12. NIST Chemistry Reference: METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE(184705-03-1)
    13. EPA Substance Registry System: METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE(184705-03-1)

  • Safety Data

    1. Hazard Codes: Xi
    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: 184705-03-1(Hazardous Substances Data)

184705-03-1 Usage

Uses

Used in Pharmaceutical Industry:
METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE is used as a potential active pharmaceutical ingredient for the development of medications targeting mood disorders, anxiety, and depression. Its ability to modulate the neurotransmitter 5-hydroxytryptamine offers a promising avenue for further research and development in the field of medicinal chemistry.
METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE is used as a research compound for studying the mechanisms of mood regulation and behavior. Its unique structural features provide valuable insights into the development of novel therapeutic agents for the treatment of mood-related disorders.
METHYL 1-BENZYL-2-ETHYL-5-HYDROXY-1H-INDOLE-3-CARBOXYLATE is used as a chemical intermediate in the synthesis of other pharmaceutical compounds. Its versatile structure allows for the development of new drugs with improved efficacy and safety profiles for the treatment of various mood disorders.

Check Digit Verification of cas no

The CAS Registry Mumber 184705-03-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,8,4,7,0 and 5 respectively; the second part has 2 digits, 0 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 184705-03:
(8*1)+(7*8)+(6*4)+(5*7)+(4*0)+(3*5)+(2*0)+(1*3)=141
141 % 10 = 1
So 184705-03-1 is a valid CAS Registry Number.
InChI:InChI=1/C19H19NO3/c1-3-16-18(19(22)23-2)15-11-14(21)9-10-17(15)20(16)12-13-7-5-4-6-8-13/h4-11,21H,3,12H2,1-2H3

184705-03-1Relevant articles and documents

Synthesis of indomethacin analogues for evaluation as modulators of MRP activity

Maguire, Anita R.,Plunkett, Stephen J.,Papot, Sébastien,Clynes, Martin,O'Connor, Robert,Touhey, Samantha

, p. 745 - 762 (2007/10/03)

Synthesis of a range of indomethacin analogues, required for investigation in combination toxicity assays, bearing both N-benzyl and N-benzoyl groups, is described. Copyright

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