1,2-Thiazole-4-carboxylic acid
1,2-Thiazole-4-carboxylic acid structure
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Common Name | 1,2-Thiazole-4-carboxylic acid | ||
|---|---|---|---|---|
| CAS Number | 822-82-2 | Molecular Weight | 129.137 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 175.8±23.0 °C at 760 mmHg | |
| Molecular Formula | C4H3NO2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 60.1±22.6 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Isothiazole-4-carboxylic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 175.8±23.0 °C at 760 mmHg |
| Molecular Formula | C4H3NO2S |
| Molecular Weight | 129.137 |
| Flash Point | 60.1±22.6 °C |
| Exact Mass | 128.988449 |
| PSA | 78.43000 |
| LogP | 0.49 |
| Vapour Pressure | 0.7±0.4 mmHg at 25°C |
| Index of Refraction | 1.618 |
| InChIKey | PCXTYKGTWQCNJI-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cnsc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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1,2-Thiazole-4-... CAS#:822-82-2 |
| Literature: Journal of medicinal chemistry, , vol. 13, # 6 p. 1208 - 1212 |
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1,2-Thiazole-4-... CAS#:822-82-2 |
| Literature: Journal of the Chemical Society, , p. 3061,3065 |
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1,2-Thiazole-4-... CAS#:822-82-2 |
| Literature: Journal of Medicinal Chemistry, , vol. 11, # 1 p. 70 - 73 |
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1,2-Thiazole-4-... CAS#:822-82-2 |
| Literature: Journal of the Chemical Society, , p. 3061,3065 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 4 | |
|---|---|
| DownStream 2 | |
CAS#:10271-90-6
CAS#:170283-02-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Agonist activity at human cloned GPR109a receptor by forskolin-stimulated cAMP produc...
Source: ChEMBL
Target: Hydroxycarboxylic acid receptor 2
External Id: CHEMBL924060
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1,2-Thiazole-4-carboxylic acid |
| 4-Isothiazolecarboxylic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of Isothiazole-4-carboxylic acid? |
| A: Boiling point of Isothiazole-4-carboxylic acid is 175.8±23.0 °C at 760 mmHg. |
| Q: What is the polar surface area (PSA) of Isothiazole-4-carboxylic acid? |
| A: Polar surface area (PSA) of Isothiazole-4-carboxylic acid is 78.43000. |
| Q: What is the molecular weight of Isothiazole-4-carboxylic acid? |
| A: Molecular weight of Isothiazole-4-carboxylic acid is 129.137. |
| Q: What is the CAS number of Isothiazole-4-carboxylic acid? |
| A: CAS number of Isothiazole-4-carboxylic acid is 822-82-2. |
| Q: What are the downstream products of Isothiazole-4-carboxylic acid? |
| A: Related downstream products(CAS) of Isothiazole-4-carboxylic acid: 10271-90-6;170283-02-0. |
| Q: What is the English name of Isothiazole-4-carboxylic acid? |
| A: The English name of Isothiazole-4-carboxylic acid is Isothiazole-4-carboxylic acid. |
| Q: What is the InChIKey of Isothiazole-4-carboxylic acid? |
| A: InChIKey of Isothiazole-4-carboxylic acid is PCXTYKGTWQCNJI-UHFFFAOYSA-N. |
| Q: What English synonyms does Isothiazole-4-carboxylic acid have? |
| A: English synonyms of Isothiazole-4-carboxylic acid: 1,2-Thiazole-4-carboxylic acid, 4-Isothiazolecarboxylic acid. |
| Q: What is the SMILES notation of Isothiazole-4-carboxylic acid? |
| A: SMILES notation of Isothiazole-4-carboxylic acid is O=C(O)c1cnsc1. |
| Q: What is the molecular formula of Isothiazole-4-carboxylic acid? |
| A: Molecular formula of Isothiazole-4-carboxylic acid is C4H3NO2S. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |