3H-1,2,4-Triazole-3-thione,5-ethyl-1,2-dihydro-(9CI)
3H-1,2,4-Triazole-3-thione,5-ethyl-1,2-dihydro-(9CI) structure
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Common Name | 3H-1,2,4-Triazole-3-thione,5-ethyl-1,2-dihydro-(9CI) | ||
|---|---|---|---|---|
| CAS Number | 7271-45-6 | Molecular Weight | 129.18300 | |
| Density | 1.297g/cm3 | Boiling Point | 293.287ºC at 760 mmHg | |
| Molecular Formula | C4H7N3S | Melting Point | N/A | |
| MSDS | USA | Flash Point | 131.175ºC | |
Summary: Chinese name: 5-乙基-1,2-二氢-(9ci)-3H-1,2,4-三唑-3-硫酮, English name: 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione, CAS number: 7271-45-6, molecular formula: C4H7N3S, molecular weight: 129.18300. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione |
|---|---|
| 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 | 1.297g/cm3 |
|---|---|
| Boiling Point | 293.287ºC at 760 mmHg |
| Molecular Formula | C4H7N3S |
| Molecular Weight | 129.18300 |
| Flash Point | 131.175ºC |
| Exact Mass | 129.03600 |
| PSA | 80.37000 |
| LogP | 0.65580 |
| Index of Refraction | 1.611 |
| InChIKey | QKCNMYZGZIKYHA-UHFFFAOYSA-N |
| SMILES | CCc1nc(=S)[nH][nH]1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~96%
3H-1,2,4-Triazo... CAS#:7271-45-6 |
| Literature: Vardhan, V. Aditya; Kumar, V. Ravi; Rao, V. Rajeswar Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1999 , vol. 38, # 1 p. 18 - 23 |
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~48%
3H-1,2,4-Triazo... CAS#:7271-45-6 |
| Literature: Heravi, Majid M.; Sadjadi, Sodeh; Hekmatshoar, Rahim; Oskooie, Hossein A.; Bamoharram, Fatemeh F. Monatshefte fur Chemie, 2008 , vol. 139, # 2 p. 107 - 110 |
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~%
3H-1,2,4-Triazo... CAS#:7271-45-6 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 7, # 1 p. 57 - 62 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
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| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. 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: Inhibition of Pseudomonas aeruginosa beta-lactamase IMP-1 expressed in Escherichia co...
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL1936967
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Name: Inhibition of Pseudomonas aeruginosa beta-lactamase IMP-1 expressed in Escherichia co...
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL1936966
|
|
Name: Inhibition of Pseudomonas aeruginosa beta-lactamase IMP-1 expressed in Escherichia co...
Source: ChEMBL
Target: Beta-lactamase
External Id: CHEMBL1936965
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Ethyl-5-mercapto-1,2,4-triazol |
| 3-Ethyl-5-mercapto-4H-triazol |
| 5-ethyl-4H-1,2,4-triazole-3-thiol |
| 5-ethyl-2,4-dihydro-[1,2,4]triazole-3-thione |
| 2-mercapto-5-ethyl-1,3,4-triazole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: The English name of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione. |
| Q: What is the molecular formula of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: Molecular formula of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is C4H7N3S. |
| Q: What is the SMILES notation of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: SMILES notation of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is CCc1nc(=S)[nH][nH]1. |
| Q: What is the CAS number of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: CAS number of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is 7271-45-6. |
| Q: What is the InChIKey of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: InChIKey of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is QKCNMYZGZIKYHA-UHFFFAOYSA-N. |
| Q: What is the molecular weight of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: Molecular weight of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is 129.18300. |
| Q: What is the boiling point of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: Boiling point of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is 293.287ºC at 760 mmHg. |
| Q: What is the LogP of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: LogP of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione is 0.65580. |
| Q: What English synonyms does 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione have? |
| A: English synonyms of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione: 3-Ethyl-5-mercapto-1,2,4-triazol, 3-Ethyl-5-mercapto-4H-triazol, 5-ethyl-4H-1,2,4-triazole-3-thiol, 5-ethyl-2,4-dihydro-[1,2,4]triazole-3-thione, 2-mercapto-5-ethyl-1,3,4-triazole. |
| Q: What are the upstream materials of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione? |
| A: Related upstream materials(CAS) of 5-ethyl-1,2-dihydro-1,2,4-triazole-3-thione: 20939-16-6;79-03-8;79-19-6. |
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. |