CAS Number125971-94-0
SynonymsATS-8; (4R,Cis)-1,1-dimethylethyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate; tert-Butyl (4R,6R)-6-CyanoMethyl-2,2-diMethyl-1,3-dioxane-4-acetate; EINECS 425-780-3; 2-Methyl-2-propanyl [(4R,6R)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate; MFCD03093958; (4R-cis)-1,1-Dimethylethyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate; (4R,6R)-6-Cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetic Acid tert-Butyl Ester; tert-Butyl 6-cyanomethyl-2,2-dimethyl-1,3-dioxolane-4-acetate; tert-Butyl [(4R,6R)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
Molecular FormulaC14H23NO4
Molecular Weight269.34
Purity97%
Density1.0±0.1 g/cm3
Boiling Point364.1±17.0 °C at 760 mmHg
Melting Point65-69 °C (lit.)
AppearanceWhite to light yellow crystal powder
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 125971-94-0 |
| Catalog No. | 2A-9051709 |
| Chinese Name | tert-丁基(4R,3R)-6-cyano甲基-2,2-二甲基-1,3-二氧杂环乙烷-4-乙酸, |
| Synonyms | ATS-8; (4R,Cis)-1,1-dimethylethyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate; tert-Butyl (4R,6R)-6-CyanoMethyl-2,2-diMethyl-1,3-dioxane-4-acetate; EINECS 425-780-3; 2-Methyl-2-propanyl [(4R,6R)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate; MFCD03093958; (4R-cis)-1,1-Dimethylethyl-6-cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetate; (4R,6R)-6-Cyanomethyl-2,2-dimethyl-1,3-dioxane-4-acetic Acid tert-Butyl Ester; tert-Butyl 6-cyanomethyl-2,2-dimethyl-1,3-dioxolane-4-acetate; tert-Butyl [(4R,6R)-6-(cyanomethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate |
| Molecular Formula | C14H23NO4 |
| Molecular Weight | 269.34 |
| Purity | 97 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 364.1±17.0 °C at 760 mmHg |
| Melting Point | 65-69 °C (lit.) |
| Appearance | White to light yellow crystal powder |
| Water Solubility | Soluble in: chloroform |
| Storage Condition | Store under inert gas; avoid air |
| HTC | 2932999099 |
| PubChem ID | 24878377 |
| MDL Number | MFCD03093958 |
| SMILES | CC(C)(C)OC(=O)C[C@H]1C[C@@H](CC#N)OC(C)(C)O1 |
| InChI | 1S/C14H23NO4/c1-13(2,3)19-12(16)9-11-8-10(6-7-15)17-14(4,5)18-11/h10-11H,6,8-9H2,1-5H3/t10-,11-/m1/s1 |
| InChI Key | DPNRMEJBKMQHMC-GHMZBOCLSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352005 |
| Hazard Symbols | transportation |
| MSDS | msds/51709_1_125971_94_0.pdf |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: No dangerous goods IMDG Code: No dangerous goods International Air Transport Dangerous Regulations: No dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special precautions for users No data available |
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