CAS Number118307-04-3
SynonymsMFCD04115735; 5-(Chloroacetyl)-1H-indol-6-yl hypochlorite; 6-Chloro-5-(chloroacetyl)-1,3-dihydro-2H-indol-2-one; Hypochlorous acid, 5-(2-chloroacetyl)-1H-indol-6-yl ester; 6-chloro-5-(2-chloroacetyl)-1,3-dihydroindol-2-one
Molecular FormulaC22H21ClO8
Molecular Weight448.861
Purity98%
Density1.5±0.1 g/cm3
Boiling Point430.1±45.0 °C at 760 mmHg
Melting Point202-206ºC
Appearancelight brown solid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 118307-04-3 |
| Catalog No. | 2A-9006468 |
| Chinese Name | 5-氯乙酰-6-氯-1,3-二氢-2H-吲哚-2-酮 |
| Synonyms | MFCD04115735; 5-(Chloroacetyl)-1H-indol-6-yl hypochlorite; 6-Chloro-5-(chloroacetyl)-1,3-dihydro-2H-indol-2-one; Hypochlorous acid, 5-(2-chloroacetyl)-1H-indol-6-yl ester; 6-chloro-5-(2-chloroacetyl)-1,3-dihydroindol-2-one |
| Molecular Formula | C22H21ClO8 |
| Molecular Weight | 448.861 |
| Purity | 98 |
| Density | 1.5±0.1 g/cm3 |
| Boiling Point | 430.1±45.0 °C at 760 mmHg |
| Melting Point | 202-206ºC |
| Appearance | light brown solid |
| HTC | 2933790090 |
| MDL Number | MFCD00710556 |
| SMILES | O=C1Cc2cc(C(=O)CCl)c(Cl)cc2N1 |
| InChI | InChI=1S/C10H7Cl2NO2/c11-4-9(14)6-1-5-2-10(15)13-8(5)3-7(6)12/h1,3H,2,4H2,(H,13,15) |
| InChI Key | LWWVMDRRHHCTMZ-UHFFFAOYSA-N |
| MSDS | msds/6468_1_118307_04_3.pdf |
| Use of | health and chemical hazard data given on this sheet. 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: Flash point:No data Molecular weight:244.1 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen chloride. 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; Risk Phrases R34 RIDADR UN 3261 HS Code 2933790090 Synthetic Route 6-Chloro 2-oxindole CAS#:56341-37-8 Chloroacetyl ch... CAS#:79-04-9 5-Chloroacetyl-... CAS#:118307-04-3 Literature: Journal of Medicinal Chemistry, , vol. 39, # 1 p. 143 - 148 Chloroacetyl ch... CAS#:79-04-9 5-Chloroacetyl-... CAS#:118307-04-3 1,4-Dichloro-2-... CAS#:89-61-2 5-Chloroacetyl-... CAS#:118307-04-3 Precursor & DownStream Precursor 4 CAS#:56341-37-8 6-Chloro 2-oxindole CAS#:79-04-9 Chloroacetyl ch... CAS#:89-61-2 1,4-Dichloro-2-... CAS#:147124-32-1 Dimethyl 2-(4-c... DownStream 3 CAS#:122883-93-6 Ziprasidone HCl CAS#:118289-55-7 6-Chloro-5-(2-c... CAS#:884305-06-0 2H-Indol-2-one,... |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 9.0% Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0% |
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