CAS 1116-98-9|tert-Butyl 2-cyanoacetate
Introduction：Basic information about CAS 1116-98-9|tert-Butyl 2-cyanoacetate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | tert-Butyl 2-cyanoacetate | ||
|---|---|---|---|
| CAS Number | 1116-98-9 | Molecular Weight | 141.168 |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 194.6±8.0 °C at 760 mmHg |
| Molecular Formula | C7H11NO2 | Melting Point | 107-108ºC |
| MSDS | ChineseUSA | Flash Point | 79.0±5.2 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | tert-Butyl cyanoacetate |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 194.6±8.0 °C at 760 mmHg |
| Melting Point | 107-108ºC |
| Molecular Formula | C7H11NO2 |
| Molecular Weight | 141.168 |
| Flash Point | 79.0±5.2 °C |
| Exact Mass | 141.078979 |
| PSA | 50.09000 |
| LogP | 0.76 |
| Vapour Pressure | 0.4±0.4 mmHg at 25°C |
| Index of Refraction | 1.426 |
| InChIKey | BFNYNEMRWHFIMR-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)CC#N |
| Storage condition | 2-8°C |
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn: Harmful; |
| Risk Phrases | R22 |
| Safety Phrases | S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2926909090 |
Customs
| HS Code | 2926909090 |
|---|---|
| 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% |
Articles2
More Articles| Modular isoquinoline synthesis using catalytic enolate arylation and in situ functionalization. Org. Lett. 15(24) , 6190-3, (2013) A methyl ketone, an aryl bromide, an electrophile, and ammonium chloride were combined in a four-component, three-step, and one-pot coupling procedure to furnish substituted isoquinolines in overall y... | |
| Synthesis of jenamidines A1/A2. Org. Lett. 7(20) , 4519-22, (2005) [reaction: see text] Addition of the enolate of tert-butyl acetate to cyanamide methyl ester 17 followed by treatment with LHMDS afforded vinylogous urea 19 in 27% yield. Vinylogous urea 19 was also o... |
Synonyms
| tert-Butyl cyanoacetate |
| Cyanoacetic Acid tert-Butyl Ester |
| tert-butyl 2-cyanoacetate |
| MFCD00001938 |
| 2-Methyl-2-propanyl cyanoacetate |
| tert-Butylcyanacetat |
| EINECS 214-243-7 |
| Acetic acid, cyano-, 1,1-dimethylethyl ester |
| Acetic acid, cyano-, tert-butyl ester |
| Acetic acid, 2-cyano-, 1,1-dimethylethyl ester |
