129075-49-6

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• Basic information

  1. Product Name: 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE
  2. Synonyms: 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE;5-Methoxy-1,2,3,4-tetrahydroisoquinolin-1-one;5-Methoxy-3,4-dihydro-2H-isoquinolin-1-one;5-Methoxy-3,4-dihydroisoquinolin-1(2H)
  3. CAS NO:129075-49-6
  4. Molecular Formula: C₁₀H₁₁NO₂
  5. Molecular Weight: 177.1998
  6. EINECS: N/A
  7. Product Categories: N/A
  8. Mol File: 129075-49-6.mol
  9. Article Data: 10

• Chemical Properties

  1. Melting Point: N/A
  2. Boiling Point: 439.8 °C at 760 mmHg
  3. Flash Point: 219.8 °C
  4. Appearance: /
  5. Density: 1.159g/cm³
  6. Vapor Pressure: 6.2E-08mmHg at 25°C
  7. Refractive Index: 1.548
  8. Storage Temp.: Sealed in dry,Room Temperature
  9. Solubility: N/A
  10. CAS DataBase Reference: 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE(CAS DataBase Reference)
  11. NIST Chemistry Reference: 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE(129075-49-6)
  12. EPA Substance Registry System: 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE(129075-49-6)

• 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: 129075-49-6(Hazardous Substances Data)

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129075-49-6 Usage

General Description

5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE, also known as 3-Methoxy-N-methyl-6-dihydroisoquinolin-1(2H)-one, is a chemical compound with the molecular formula C11H13NO2. It is a derivative of isoquinolinone and is primarily used for research purposes. 5-METHOXY-3,4-DIHYDRO-1(2H)-ISOQUINOLINONE has been studied for its potential pharmaceutical applications, particularly in the field of neuroscience. It has shown to have activity as an antagonist at N-methyl-D-aspartate (NMDA) receptors, which are involved in processes such as learning and memory. Additionally, it has demonstrated potential as a dopamine receptor antagonist. Further research is ongoing to explore the full range of its pharmacological properties and potential therapeutic applications.

Check Digit Verification of cas no

The CAS Registry Mumber 129075-49-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,9,0,7 and 5 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 129075-49:
(8*1)+(7*2)+(6*9)+(5*0)+(4*7)+(3*5)+(2*4)+(1*9)=136
136 % 10 = 6
So 129075-49-6 is a valid CAS Registry Number.

InChI:InChI=1/C10H11NO2/c1-13-9-4-2-3-8-7(9)5-6-11-10(8)12/h2-4H,5-6H2,1H3,(H,11,12)

129075-49-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name	5-methoxy-3,4-dihydro-2H-isoquinolin-1-one

1.2 Other means of identification

Product number	-
Other names	F2679-0001

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:129075-49-6 SDS

129075-49-6Upstream product

• 258882-54-1 N-(methoxycarbonyl)-2-(2-methoxyphenyl)ethylamine 
• 56469-02-4 3,4-dihydro-5-hydroxy-1(2H)-isoquinolinone 
• 333-27-7 methyl trifluoromethanesulfonate 
• 103205-24-9 4-methoxy-1-indanone oxime 
• 2045-79-6 o-methoxy-2-phenylethylamine 
• 74-88-4 methyl iodide 
• 13336-31-7 4-methoxylindanone 
• 40731-98-4 4-hydroxy-2,3-dihydroindan-1-one 

129075-49-6Downstream Products

• 103030-70-2 5-methoxy-1,2,3,4-tetrahydro-isoquinoline 

129075-49-6Relevant articles and documents

Synthesis of 3,4-dihydro-5-[11C]methoxy-1(2H)-isoquinolinone as a Potential Tracer for Poly(ADP-ribose) Synthetase

Miyake, Yoshinori,Shimadzu, Hiroshi,Hashimoto, Naoto,Ishida, Yoshio,Shibakawa, Masahiko,Nishimura, Tsunehiko

, p. 983 - 988 (2000)

Synthesis of 3,4-dihydro-5-[11C]methoxy-1(2H)-isoquinolinone ([11C]MIQO), a potent poly (ADP-ribose) synthetase inhibitor, was devised in order to evaluate whether it is possible to image excessive activation of poly(ADP-ribose) synthetase (PARS) by positron emission tomography. [11C]MIQO was prepared by O-[11C]methylation of 3,4-dihydro-5-hydroxy-1(2H)-isoquinolinone, obtained by a Schmidt reaction with 4-hydroxy-1-indanone, sodium azide and trichloroacetic acid, with [11C]methyl triflate. Total synthesis time from EOB was 35 minutes. The radiochemical yield based on [11C]carbon dioxide was 31 +/- 8 percent (n=8; decay corrected). The final product had a specific activity of 76 GBq/umol at EOS, and the radiochemical purity of [11C]MIQO was over 99 percent.

17a-HYDROXYLASE/C17,20-LYASE INHIBITORS

-

Paragraph 0355, (2014/03/21)

The present invention provides compounds of Formula (I), or a pharmaceutically acceptable salt thereof, where R1, R2, R3, R4, R5, R6, A and n are as defined herein. A deuteriated derivative of the compound of Formula (I) is also provided.

17α-HYDROXYLASE/C17,20-LYASE INHIBITORS

-

Page/Page column 60, (2012/04/04)

The present invention provides compounds of Formula (I), or a pharmaceutically acceptable salt thereof, where R1, R2, R3, R4, R5, R6, A and n are as defined herein. A deuteriated derivative of the compound of Formula (I) is also provided.

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