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CAS

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129689-88-9

3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID

    Cas No: 129689-88-9

  • USD $ 1.9-2.9 / Gram

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  • 129689-88-9 Structure

  • Basic information

    1. Product Name: 3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID
    2. Synonyms: 2-Indolecarboxylicacid, 4,5,6,7-tetrahydro-4-keto-3,6,6-trimethyl- (3CI)
    3. CAS NO:129689-88-9
    4. Molecular Formula: C12H15NO3
    5. Molecular Weight: 221.26
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 129689-88-9.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 454.6°Cat760mmHg
    3. Flash Point: 228.7°C
    4. Appearance: /
    5. Density: g/cm3
    6. Vapor Pressure: 4.71E-09mmHg at 25°C
    7. Refractive Index: 1.572
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 4.67±0.40(Predicted)
    11. CAS DataBase Reference: 3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID(129689-88-9)
    13. EPA Substance Registry System: 3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID(129689-88-9)

  • 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: 129689-88-9(Hazardous Substances Data)

129689-88-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 129689-88-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,9,6,8 and 9 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 129689-88:
(8*1)+(7*2)+(6*9)+(5*6)+(4*8)+(3*9)+(2*8)+(1*8)=189
189 % 10 = 9
So 129689-88-9 is a valid CAS Registry Number.
InChI:InChI=1/C12H15NO3/c1-6-9-7(13-10(6)11(15)16)4-12(2,3)5-8(9)14/h13H,4-5H2,1-3H3,(H,15,16)

129689-88-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 3,6,6-trimethyl-4-oxo-5,7-dihydro-1H-indole-2-carboxylic acid

1.2 Other means of identification

Product number -
Other names 3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-indole-2-carboxylic acid

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:129689-88-9 SDS

129689-88-9Relevant articles and documents

INHIBITORS OF METALLO-BETA-LACTAMASES

-

, (2018/12/13)

The present invention relates to compounds of Formula (I) that function as inhibitors of bacterial metallo-beta-lactamases. The present invention also relates to processes for the preparation of these compounds, to pharmaceutical compositions comprising them, and to their use in the treatment of a bacterial infection. (Formula (I))

The Chemistry of Pyrrolic Compounds. LXIII Synthetic Studies of Petroporphyrins with Fused Six-Membered Ring Systems

Clezy, Peter S.,Prashar, Jognandan K.

, p. 825 - 837 (2007/10/02)

Several approaches to the synthesis of porphyrins bearing fused six-membered ring systems were explored with the aim of obtaining the petroporphyrin (4a).This was ultimately achieved by an intramolecular cyclization of a porphyrin with a propanoyl chloride side chain in the presence of stannic chloride.Methylation of the intermediate ketone with CH3Li and reduction of the resultant alcohol with NaBH3CN/ZnI furnished (4a).

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