CAS Number3816-66-8
Synonyms5-Cyan-o-kresol; BEN162; 3-Hydroxy-4-methylbenzonitrile; 3-Hydroxy-4-methylbenzonitril; 4-cyanocresol; 3-Hydroxy-4-methyl-benzonitrile; Benzonitrile,3-hydroxy-4-methyl; 5-CYANO-2-METHYLPHENOL
Molecular FormulaC8H7NO
Molecular Weight133.147
Purity96+%
Density1.2±0.1 g/cm3
Boiling Point276.9±28.0 °C at 760 mmHg
EINECS0
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 3816-66-8 |
| Catalog No. | 2A-1131535 |
| Chinese Name | 3-羟基-4-甲基苯腈 |
| Synonyms | 5-Cyan-o-kresol; BEN162; 3-Hydroxy-4-methylbenzonitrile; 3-Hydroxy-4-methylbenzonitril; 4-cyanocresol; 3-Hydroxy-4-methyl-benzonitrile; Benzonitrile,3-hydroxy-4-methyl; 5-CYANO-2-METHYLPHENOL |
| Molecular Formula | C8H7NO |
| Molecular Weight | 133.147 |
| Purity | 96+ |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 276.9±28.0 °C at 760 mmHg |
| Storage Condition | room temperature |
| EINECS | 0 |
| HTC | 2926909090 |
| UN(IATA) | 0 |
| SMILES | Cc1ccc(C#N)cc1O |
| InChI | InChI=1S/C8H7NO/c1-6-2-3-7(5-9)4-8(6)10/h2-4,10H,1H3 |
| InChI Key | UXNPMDKLHYMKBZ-UHFFFAOYSA-N |
| MSDS | msds/131535_1_3816_66_8.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels. 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: Flash point:No data Molecular formula:C8H7NO Molecular weight:133.1 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen 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 HS Code 2926909090 Synthetic Route 3-benzyloxy-4-m... CAS#:1188374-87-9 3-Hydroxy-4-met... CAS#:3816-66-8 3-Amino-p-tolun... CAS#:60710-80-7 3-Hydroxy-4-met... CAS#:3816-66-8 Literature: Reiner, John E.; Siev, Daniel V.; Araldi, Gian-Luca; Cui, Jingrong Jean; Ho, Jonathan Z.; Reddy, Komandla Malla; Mamedova, Lala; Vu, Phong H.; Lee, Kuen-Shan S.; Minami, Nathaniel K.; Gibson, Tony S.; Anderson, Susanne M.; Bradbury, Annette E.; Nolan, Thomas G.; Semple, J. Edward Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 8 p. 1203 - 1208 4-Bromo-o-cresol CAS#:2362-12-1 3-Hydroxy-4-met... CAS#:3816-66-8 Literature: Kowa Co., Ltd. Patent: US6046212 A1, 2000 ; Precursor & DownStream Precursor 7 CAS#:1188374-87-9 3-benzyloxy-4-m... CAS#:60710-80-7 3-Amino-p-tolun... CAS#:2362-12-1 4-Bromo-o-cresol CAS#:42872-74-2 3-Bromo-4-methy... DownStream 9 CAS#:3556-60-3 3-Methoxy-4-met... CAS#:84102-89-6 4-Cyano-2-hydro... CAS#:6946-15-2 3-HYDROXY-4-MET... CAS#:586-30-1 3-Hydroxy-4-met... |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 6.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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