CAS Number4651-91-6
SynonymsEINECS 225-085-3; 2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile; 2-AMINO-4,5,6,7-TETRAHYDROBENZO(B)THIOPHENE-3-CARBONITRILE; MFCD00128278
Molecular FormulaC9H10N2S
Molecular Weight178.257
Density1.27 g/cm3
Boiling Point398.1ºC at 760 mmHg
Melting Point151-153°C
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 4651-91-6 |
| Catalog No. | 2A-9084834 |
| Chinese Name | 2-氨基-4,5,6,7-四氢苯并[b]噻吩-3-腈 |
| Synonyms | EINECS 225-085-3; 2-Amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile; 2-AMINO-4,5,6,7-TETRAHYDROBENZO(B)THIOPHENE-3-CARBONITRILE; MFCD00128278 |
| Molecular Formula | C9H10N2S |
| Molecular Weight | 178.257 |
| Density | 1.27 g/cm3 |
| Boiling Point | 398.1ºC at 760 mmHg |
| Melting Point | 151-153°C |
| Storage Condition | Room temperature, protected from light, stored in |
| HTC | 2934999090 |
| MDL Number | MFCD00128278 |
| SMILES | N#Cc1c(N)sc2c1CCCC2 |
| InChI | InChI=1S/C9H10N2S/c10-5-7-6-3-1-2-4-8(6)12-9(7)11/h1-4,11H2 |
| InChI Key | ADHVMGAFAKSNOM-UHFFFAOYSA-N |
| Use of | health and chemical hazard data given on this sheet. Storage:Store in closed vessels, refrigerated. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point:No data Flash point:No data Molecular formula:C9H10N2S Molecular weight:178.3 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, sulfur oxides. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Safety Information Hazard Codes Xi: Irritant; RIDADR 3439 HS Code 2934999090 Synthetic Route Total: 1 Page Cyclohexanone CAS#:108-94-1 Malononitrile CAS#:109-77-3 2-AMINO-4,5,6,7... CAS#:4651-91-6 Literature: Zhao, Dan-Dan; Li, Li; Xu, Fan; Wu, Qi; Lin, Xian-Fu Journal of Molecular Catalysis B: Enzymatic, 2013 , vol. 95, p. 29 - 35 CYCLOHEXYLIDENE... CAS#:4354-73-8 2-AMINO-4,5,6,7... CAS#:4651-91-6 Literature: Feroci, Marta; Chiarotto, Isabella; Rossi, Leucio; Inesi, Achille Advanced Synthesis and Catalysis, 2008 , vol. 350, # 17 p. 2740 - 2746 Cyclohexanone CAS#:108-94-1 2-AMINO-4,5,6,7... CAS#:4651-91-6 Literature: Hu, Yi; Chen, Zhen-Chu; Le, Zhang-Gao; Zheng, Qin-Guo Synthetic Communications, 2004 , vol. 34, # 20 p. 3801 - 3806 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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