234445-61-5

Basic information

• Product Name: 4-Thiazolecarboxylicacid,2-(1-methylethyl)-(9CI)
• Synonyms: 4-Thiazolecarboxylicacid,2-(1-methylethyl)-(9CI);2-isopropyl-1,3-thiazole-4-carboxylic acid;2-Isopropylthiazole-4-carboxylic acid;2-isopropyl-1,3-thiazole-4-carboxylic acid(SALTDATA: FREE);2 - isopropyl-4 - carboxylic acid thiazol;4-Thiazolecarboxylicacid, 2-(1-Methylethyl);2-isopropyl-4-thiazolecarboxylic acid;2-propan-2-yl-1,3-thiazole-4-carboxylic acid
• CAS NO: 234445-61-5
• Molecular Formula: C₇H₉NO₂S
• Molecular Weight: 171.22
• EINECS: 1312995-182-4
• Product Categories: ISOPROPYL
• Mol File: 234445-61-5.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 297.66 °C at 760 mmHg
• Flash Point: 133.82 °C
• Appearance: /
• Density: 1.271 g/cm³
• Vapor Pressure: 0.001mmHg at 25°C
• Refractive Index: 1.564
• Storage Temp.: 2-8°C
• PKA: 4.16±0.10(Predicted)
• CAS DataBase Reference: 4-Thiazolecarboxylicacid,2-(1-methylethyl)-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 4-Thiazolecarboxylicacid,2-(1-methylethyl)-(9CI)(234445-61-5)
• EPA Substance Registry System: 4-Thiazolecarboxylicacid,2-(1-methylethyl)-(9CI)(234445-61-5)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 234445-61-5(Hazardous Substances Data)

Usage

Description

4-Thiazolecarboxylic acid, 2-(1-methylethyl)-(9CI), also known as 2-Isopropylthiazole-4-carboxylic Acid, is an organic compound with the molecular formula C6H7NO2S. It is a chemical reactant that plays a significant role in the synthesis of various pharmaceutical compounds due to its unique chemical structure and reactivity.

Uses

Used in Pharmaceutical Industry:
4-Thiazolecarboxylic acid, 2-(1-methylethyl)-(9CI) is used as a chemical reactant for the preparation of new M3 muscarinic antagonists. These antagonists are essential in the development of medications targeting various conditions, such as overactive bladder, chronic obstructive pulmonary disease (COPD), and certain gastrointestinal disorders. The compound's unique structure allows for the creation of novel M3 antagonists with improved efficacy and reduced side effects.
Used in Antifungal Applications:
In the field of antifungal drug development, 4-Thiazolecarboxylic acid, 2-(1-methylethyl)-(9CI) is utilized in the novel synthesis of Cystothiazole C. Cystothiazole C is a potential antifungal agent that shows promise in treating various fungal infections. The compound's incorporation into the synthesis process contributes to the development of new antifungal drugs with enhanced potency and selectivity, offering better treatment options for patients suffering from fungal infections.

InChI:InChI=1/C7H9NO2S/c1-4(2)6-8-5(3-11-6)7(9)10/h3-4H,1-2H3,(H,9,10)

Upstream product

• 336193-96-5 methyl 2-isopropylthiazole-4-carboxylate 

Downstream Products

• 1414360-91-0 C₂₅H₃₂FN₃O₃S 
• 1414360-74-9 C₂₅H₃₂FN₃O₃S 
• 1414360-86-3 [9-[[3-[2-tert-butoxyvinyl]-4-fluorophenyl]methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-(2-isopropylthiazol-4-yl)methanone 
• 1414360-94-3 C₂₈H₃₈FN₃O₃S 
• 1179337-61-1 [3-[[4-fluoro-3-[2-methoxyvinyl]phenyl]methyl]-7-oxa-3,10-diazaspiro[5.5]undecan-10-yl]-(2-isopropylthiazol-4-yl)methanone 
• 1414360-84-1 2-[benzyl-[2-[2-fluoro-5-[[4-(2-isopropylthiazole-4-carbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methyl]phenyl]ethyl]amino]-1-(4-tert-butoxy-2-isopropoxy-1,3-benzothiazol-7-yl)ethanone 
• 1414397-22-0 C₂₄H₃₃FN₄O₂S 
• 1414360-80-7 3-[2-fluoro-5-[[4-(2-isopropylthiazole-4-carbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methyl]phenyl]propanamide 
• 1414360-79-4 3-[2-fluoro-5-[[4-(2-isopropylthiazole-4-carbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methyl]phenyl]prop-2-enamide 
• 1414360-78-3 [9-[(3-bromo-4-fluorophenyl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-(2-isopropylthiazol-4-yl)methanone 
• 1414360-83-0 [9-[[3-[2-(benzylamino)ethyl]-4-fluorophenyl]methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-(2-isopropylthiazol-4-yl)methanone 
• 1414360-85-2 [9-[[3-[2-[benzyl-[(2R)-2-(4-tert-butoxy-2-isopropoxy-1,3-benzothiazol-7-yl)-2-hydroxyethyl]amino]ethyl]-4-fluorophenyl]methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl]-(2-isopropylthiazol-4-yl)methanone 
• 1414360-76-1 2-[2-fluoro-5-[[4-(2-isopropylthiazole-4-carbonyl)-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]methyl]phenyl]acetaldehyde 
• 1310551-52-0 2-Isopropyl-thiazole-4-carboxylic acid [6-acetyl-2-chloro-3-(2,2-dimethoxy-ethoxy)-phenyl]-amide 

Relevant articles and documents

Concise synthesis of 2,4-disubstituted thiazoles from β-azido disulfides and carboxylic acids or anhydrides: Asymmetric synthesis of cystothiazole C

A novel and efficient method for the one-pot synthesis of 2,4-disubstituted thiazoles from carboxylic acids or anhydrides is presented. Based on this new method, the total synthesis of the bis-2,4-disubstituted bis(thiazoles) natural product cystothiazole C is also presented. This journal is