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Home > Products > Pharmaceutical R&D Materials > Heterocyclic Building Blocks > 2-[3-Carboxy-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylic Acid
2-[3-Carboxy-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylic Acid structure, CAS 1239233-87-4

2-[3-Carboxy-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylic Acid

CAS Number1239233-87-4

Synonyms2-(3-Carboxy-4-isobutoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid; 2-[3-Carboxy-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylic Acid

Molecular FormulaC16H17NO5S

Molecular Weight240.25

Purity

Density1.3±0.1 g/cm3

Boiling Point568.9±60.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Cat. No.: 2A-3180454 Purity:
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Quality Control of [ 1239233-87-4 ] SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number1239233-87-4
Catalog No.2A-3180454
Chinese Name2-[3-羧基-4-(2-甲基丙氧基)苯基]-4-甲基-5-噻唑羧酸
Synonyms2-(3-Carboxy-4-isobutoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid; 2-[3-Carboxy-4-(2-methylpropoxy)phenyl]-4-methyl-5-thiazolecarboxylic Acid
Molecular FormulaC16H17NO5S
Molecular Weight240.25
Density1.3±0.1 g/cm3
Boiling Point568.9±60.0 °C at 760 mmHg
Storage Conditionroom temperature
ApplicationFebuxostat dicarboxylic acid impurity is an impurity in Febuxostat. Febuxostat is a selective xanthine oxidase (XO) inhibitor with a Ki of 0.6 nM.
PubChem ID99237959
MDL NumberMFCD08436079
SMILESCc1nc(-c2ccc(OCC(C)C)c(C(=O)O)c2)sc1C(=O)O
InChIInChI=1S/C16H17NO5S/c1-8(2)7-22-12-5-4-10(6-11(12)15(18)19)14-17-9(3)13(23-14)16(20)21/h4-6,8H,7H2,1-3H3,(H,18,19)(H,20,21)
InChI KeyWSCLTDCYZOTAKS-UHFFFAOYSA-N
NACRES CodeNB.21
UNSPSC12352106
Transport InfoProduct name: 2-(3-Carboxy-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylic acid
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