5-methylthiophene-3-carbonitrile
5-methylthiophene-3-carbonitrile structure
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Common Name | 5-methylthiophene-3-carbonitrile | ||
|---|---|---|---|---|
| CAS Number | 41727-33-7 | Molecular Weight | 123.17600 | |
| Density | 1.163g/cm3 | Boiling Point | 221.058ºC at 760 mmHg | |
| Molecular Formula | C6H5NS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 87.493ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-methylthiophene-3-carbonitrile |
|---|---|
| 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 | 1.163g/cm3 |
|---|---|
| Boiling Point | 221.058ºC at 760 mmHg |
| Molecular Formula | C6H5NS |
| Molecular Weight | 123.17600 |
| Flash Point | 87.493ºC |
| Exact Mass | 123.01400 |
| PSA | 52.03000 |
| LogP | 1.92818 |
| Index of Refraction | 1.557 |
| InChIKey | ZZEFHDRVGBYNKP-UHFFFAOYSA-N |
| SMILES | Cc1cc(C#N)cs1 |
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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~84%
5-methylthiophe... CAS#:41727-33-7 |
| Literature: Bristol-Myers Squibb Company Patent: US2008/4265 A1, 2008 ; Location in patent: Page/Page column 31 ; |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 0 | |
This 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 collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-methyl-4-cyano-thiophene |
| 4-Cyano-2-methyl-thiophen |
| QC-6741 |
| 5-Methyl-3-thiophenecarbonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 5-methylthiophene-3-carbonitrile? |
| A: Molecular weight of 5-methylthiophene-3-carbonitrile is 123.17600. |
| Q: What is the English name of 5-methylthiophene-3-carbonitrile? |
| A: The English name of 5-methylthiophene-3-carbonitrile is 5-methylthiophene-3-carbonitrile. |
| Q: What English synonyms does 5-methylthiophene-3-carbonitrile have? |
| A: English synonyms of 5-methylthiophene-3-carbonitrile: 2-methyl-4-cyano-thiophene, 4-Cyano-2-methyl-thiophen, QC-6741, 5-Methyl-3-thiophenecarbonitrile. |
| Q: What is the polar surface area (PSA) of 5-methylthiophene-3-carbonitrile? |
| A: Polar surface area (PSA) of 5-methylthiophene-3-carbonitrile is 52.03000. |
| Q: What are the upstream materials of 5-methylthiophene-3-carbonitrile? |
| A: Related upstream materials(CAS) of 5-methylthiophene-3-carbonitrile: 29421-92-9;544-92-3. |
| Q: What is the SMILES notation of 5-methylthiophene-3-carbonitrile? |
| A: SMILES notation of 5-methylthiophene-3-carbonitrile is Cc1cc(C#N)cs1. |
| Q: What is the CAS number of 5-methylthiophene-3-carbonitrile? |
| A: CAS number of 5-methylthiophene-3-carbonitrile is 41727-33-7. |
| Q: What is the molecular formula of 5-methylthiophene-3-carbonitrile? |
| A: Molecular formula of 5-methylthiophene-3-carbonitrile is C6H5NS. |
| Q: What is the InChIKey of 5-methylthiophene-3-carbonitrile? |
| A: InChIKey of 5-methylthiophene-3-carbonitrile is ZZEFHDRVGBYNKP-UHFFFAOYSA-N. |
| Q: What is the boiling point of 5-methylthiophene-3-carbonitrile? |
| A: Boiling point of 5-methylthiophene-3-carbonitrile is 221.058ºC at 760 mmHg. |
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. |