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1H-Indole-7-carboxylic acid, 2,3-dihydro-, methyl ester is a chemical compound derived from the heterocyclic organic compound indole. It is a methyl ester, featuring a methyl group attached to the carboxylic acid functional group, which allows it to react with other chemicals to form new compounds with potential biological activities. This makes it a valuable building block in the pharmaceutical and chemical industries for the synthesis of various pharmaceutical drugs and therapeutic agents.

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  • 112106-91-9 Structure
  • Basic information

    1. Product Name: 1H-INDOLE-7-CARBOXYLIC ACID,2,3-DIHYDRO-,METHYL ESTER
    2. Synonyms: 1H-INDOLE-7-CARBOXYLIC ACID,2,3-DIHYDRO-,METHYL ESTER;Methyl indoline-7-carboxylate;Indoline-7-Carbocylic acid methyl ester;Indoline-7-carboxylic acid methyl ester;2,3-Dihydro-1H-indole-7-carboxylic acid methyl ester
    3. CAS NO:112106-91-9
    4. Molecular Formula: C10H11NO2
    5. Molecular Weight: 177.2
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 112106-91-9.mol
  • Chemical Properties

    1. Melting Point: 69-69.5 °C
    2. Boiling Point: 328.4±31.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.162±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C(protect from light)
    8. Solubility: N/A
    9. PKA: 3.04±0.20(Predicted)
    10. CAS DataBase Reference: 1H-INDOLE-7-CARBOXYLIC ACID,2,3-DIHYDRO-,METHYL ESTER(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1H-INDOLE-7-CARBOXYLIC ACID,2,3-DIHYDRO-,METHYL ESTER(112106-91-9)
    12. EPA Substance Registry System: 1H-INDOLE-7-CARBOXYLIC ACID,2,3-DIHYDRO-,METHYL ESTER(112106-91-9)
  • 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: 112106-91-9(Hazardous Substances Data)

112106-91-9 Usage

Uses

Used in Pharmaceutical Industry:
1H-Indole-7-carboxylic acid, 2,3-dihydro-, methyl ester is used as a key intermediate in the synthesis of pharmaceutical drugs and therapeutic agents. Its ability to react with other chemicals to form new compounds with potential biological activities makes it a valuable building block for the development of new drugs and compounds with therapeutic applications.
Used in Chemical Industry:
In the chemical industry, 1H-Indole-7-carboxylic acid, 2,3-dihydro-, methyl ester is utilized for the production of various compounds with potential applications in different fields. Its reactivity and functional group make it a versatile component in the synthesis of a wide range of chemical products.
It is important to handle 1H-Indole-7-carboxylic acid, 2,3-dihydro-, methyl ester with care and follow safety guidelines, as it may possess hazardous properties.

Check Digit Verification of cas no

The CAS Registry Mumber 112106-91-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,2,1,0 and 6 respectively; the second part has 2 digits, 9 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 112106-91:
(8*1)+(7*1)+(6*2)+(5*1)+(4*0)+(3*6)+(2*9)+(1*1)=69
69 % 10 = 9
So 112106-91-9 is a valid CAS Registry Number.

112106-91-9SDS

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 Methyl indoline-7-carboxylate

1.2 Other means of identification

Product number -
Other names methyl 2,3-dihydro-1H-indole-7-carboxylate

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:112106-91-9 SDS

112106-91-9Downstream Products

112106-91-9Relevant articles and documents

HETEROBICYCLIC AMIDES AS INHIBITORS OF CD38

-

Paragraph 0650, (2021/02/05)

The present invention relates to heterobicyclic amides and related compounds which are inhibitors of CD38 and are useful in the treatment of cancer.

IMMUNOMODULATORY COMPOUNDS

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Paragraph 0291-0293, (2020/01/24)

Disclosed are immunomodulatory compounds, pharmaceutical compositions containing them, and methods of making and using the compounds to treat diseases and disorders characterized by aberrant protein activity that can be targeted by cereblon.

A Continuous Flow Strategy for the Facile Synthesis and Elaboration of Semi-Saturated Heterobicyclic Fragments

Luise, Nicola,Wyatt, Eleanor W.,Tarver, Gary J.,Wyatt, Paul G.

, p. 1341 - 1349 (2019/01/14)

An efficient hydrogenation protocol under continuous flow conditions was developed for the synthesis of underrepresented semi-saturated bicyclic fragments containing highly sp3-rich skeletons for fragment-based drug discovery (FBDD) programs. Excellent yields were generally achieved by using Pd/C (10 % w/w) and RaNi at 25–150 °C under 4–100 bar of hydrogen pressure. The generated fragments, with appropriate physicochemical properties, present diverse hydrogen-bonding pharmacophores and useful vectors for their synthetic elaboration in the optimization stage. Successive, simple functionalizations in continuous flow were accomplished to demonstrate the opportunity to develop multi-step continuous flow synthesis of valuable starting points for FBDD campaigns. A conclusive quality control (QC) was essential to discard those structures which do not fit the typical fragment library parameters.

PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS

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, (2016/02/16)

The present invention relates to novel pyrimido-diazepinone compounds, methods of modulating protein kinases, including MPS1 (TTK), ERK5 (BMK1, MAPK7), LRKK2, EphA2, polo kinase 1,2,3, or 4, Ack1, Ack2, Abl, DCAMKL1, ABL1, Abl mutants, DCAMKL2, ARK5, BRK,

A novel series of potent and selective EP4 receptor ligands: Facile modulation of agonism and antagonism

Boyd, Michael J.,Berthelette, Carl,Chiasson, Jean-Franois,Clark, Patsy,Colucci, John,Denis, Danielle,Han, Yongxin,Lévesque, Jean-Francois,Mathieu, Marie-Claude,Stocco, Rino,Therien, Alex,Rowland, Steve,Wrona, Mark,Xu, Daigen

scheme or table, p. 484 - 487 (2011/02/27)

A novel series of EP4 ligands, based on a benzyl indoline scaffold, has been discovered. It was found that agonism and antagonism in this series can be easily modulated by minor modifications on the benzyl group. The pharmacokinetic, metabolic

A SIMPLE SYNTHESIS OF 7-SUBSTITUTED 1-ACETYL-2,3-DIHYDROINDOLES

Somei, Masanori,Kawasaki, Toshiya,Ohta, Toshiharu

, p. 2363 - 2366 (2007/10/02)

7-Cyano-, 7-hydroxy-, 7-methoxycarbonyl-, 7-methyl-, 7-nitro-, and 7-phenyl-1-acetyl-2,3-dihydroindoles are prepared in two steps (or one pot) from 1-acetyl-2,3-dihydroindole.

Cyclic carbamates and fungicidal use

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, (2008/06/13)

Fungicidally active cyclic carbamates of the formula STR1 in which X and Y each represent oxygen or sulfur, Z represents hydrogen, halogen, alkyl or nitro, and n is 2 or 3. Some intermediates are new.

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