2-((1,1-DIOXIDOBENZO[D]ISOTHIAZOL-3-YL)THIO)ACETONITRILE
![2-((1,1-DIOXIDOBENZO[D]ISOTHIAZOL-3-YL)THIO)ACETONITRILE Structure](https://image.chemsrc.com/caspic/487/80357-08-0.png)
2-((1,1-DIOXIDOBENZO[D]ISOTHIAZOL-3-YL)THIO)ACETONITRILE structure
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Common Name | 2-((1,1-DIOXIDOBENZO[D]ISOTHIAZOL-3-YL)THIO)ACETONITRILE | ||
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| CAS Number | 80357-08-0 | Molecular Weight | 238.28600 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C9H6N2O2S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 2-((1,1-DIOXIDOBENZO[D]ISOTHIAZOL-3-YL)THIO)ACETONITRILE, Chinese name: (1,1-二氧代-1H-苯并[d]异噻唑-3-基磺酰基)-乙腈, molecular formula: C9H6N2O2S2, molecular weight: 238.28600, 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 | 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile |
|---|---|
| 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.
| Molecular Formula | C9H6N2O2S2 |
|---|---|
| Molecular Weight | 238.28600 |
| Exact Mass | 237.98700 |
| PSA | 103.97000 |
| LogP | 1.90868 |
| InChIKey | MHASPMMPFSXRFD-UHFFFAOYSA-N |
| SMILES | N#CCSC1=NS(=O)(=O)c2ccccc21 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~50%
2-((1,1-DIOXIDO... CAS#:80357-08-0 |
| Literature: Rode, Haridas B.; Sprang; Besch; Loose; Otto, Hans-Hartwig Pharmazie, 2005 , vol. 60, # 10 p. 723 - 731 |
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~85%
2-((1,1-DIOXIDO... CAS#:80357-08-0 |
| Literature: Inomata, Katsuhiko; Yamada, Hiroyuki; Kotake, Hiroshi Chemistry Letters, 1981 , p. 1457 - 1458 Title/Abstract Full Text Show Details Yamada, Hiroyuki; Kinoshita, Hideki; Inomata, Katsuhiko; Kotake, Hiroshi Bulletin of the Chemical Society of Japan, 1983 , vol. 56, # 3 p. 949 - 950 |
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~%
2-((1,1-DIOXIDO... CAS#:80357-08-0 |
| Literature: Rode, Haridas B.; Sprang; Besch; Loose; Otto, Hans-Hartwig Pharmazie, 2005 , vol. 60, # 10 p. 723 - 731 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 1 | |
CAS#:7668-28-2This 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.
| Acetonitrile,[(1,1-dioxido-1,2-benzisothiazol-3-yl)thio] |
| 2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: LogP of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is 1.90868. |
| Q: What English synonyms does 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile have? |
| A: English synonyms of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile: Acetonitrile,[(1,1-dioxido-1,2-benzisothiazol-3-yl)thio], 2-((1,1-Dioxidobenzo[d]isothiazol-3-yl)thio)acetonitrile. |
| Q: What is the English name of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: The English name of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile. |
| Q: What are the downstream products of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: Related downstream products(CAS) of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile: 7668-28-2. |
| Q: What is the CAS number of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: CAS number of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is 80357-08-0. |
| Q: What is the molecular formula of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: Molecular formula of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is C9H6N2O2S2. |
| Q: What is the polar surface area (PSA) of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: Polar surface area (PSA) of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is 103.97000. |
| Q: What is the molecular weight of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: Molecular weight of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is 238.28600. |
| Q: What are the upstream materials of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: Related upstream materials(CAS) of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile: 27148-03-4;107-14-2;81-07-2. |
| Q: What is the SMILES notation of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile? |
| A: SMILES notation of 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetonitrile is N#CCSC1=NS(=O)(=O)c2ccccc21. |
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. |