CAS 7188-38-7|Tert-Butyl isocyanide
| Common Name | Tert-Butyl isocyanide | ||
|---|---|---|---|
| CAS Number | 7188-38-7 | Molecular Weight | 83.132 |
| Density | 0.735 g/mL at 25 °C(lit.) | Boiling Point | 91 °C(lit.) |
| Molecular Formula | C5H9N | Melting Point | / |
| MSDS | ChineseUSA | Flash Point | -2 °C |
| Symbol | GHS02, GHS06 | Signal Word | Danger |
Names
| Name | tert-butyl isocyanide |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 0.735 g/mL at 25 °C(lit.) |
|---|---|
| Boiling Point | 91 °C(lit.) |
| Molecular Formula | C5H9N |
| Molecular Weight | 83.132 |
| Flash Point | -2 °C |
| Exact Mass | 83.073502 |
| LogP | 0.93490 |
| Index of Refraction | n20/D 1.376(lit.) |
| InChIKey | FAGLEPBREOXSAC-UHFFFAOYSA-N |
| SMILES | [C-]#[N+]C(C)(C)C |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 710 mg/m3/4H
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,241,1975
- TYPE OF TEST :
- LC50 - Lethal concentration, 50 percent kill
- ROUTE OF EXPOSURE :
- Inhalation
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 377 mg/m3/4H
- TOXIC EFFECTS :
- Behavioral - changes in motor activity (specific assay)
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 33,241,1975
Safety Information
| Symbol | GHS02, GHS06 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H225-H330 |
| Precautionary Statements | P210-P260-P284-P310 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | F: Flammable;T: Toxic; |
| Risk Phrases | R11;R23 |
| Safety Phrases | S16-S45 |
| RIDADR | UN 1993 3/PG 2 |
| WGK Germany | 3 |
| RTECS | EQ7102500 |
| Packaging Group | II |
| Hazard Class | 3 |
| HS Code | 2929109000 |
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% |
Articles13
More Articles| Optimization of the Ugi reaction using parallel synthesis and automated liquid handling. J. Vis. Exp. (21) , doi:10.3791/942, (2008) The optimization of a Ugi reaction involving the mixing of furfurylamine, benzaldehyde, boc-glycine and t-butylisocyanide is described. Triplicate runs of 48 parallel experiments are reported, varying... | |
| Palladium-catalyzed synthesis of isocoumarins and phthalides via tert-butyl isocyanide insertion. J. Org. Chem. 77(22) , 10321-8, (2012) A novel and highly efficient strategy for the synthesis of isocoumarins and phthalides through a palladium(0)-catalyzed reaction incorporating tert-butyl isocyanide has been developed. This process, p... | |
| Towards molecular diversity: dealkylation of tert-butyl amine in Ugi-type multicomponent reaction product establishes tert-butyl isocyanide as a useful convertible isonitrile. Org. Biomol. Chem. 8(16) , 3631-4, (2010) With the development of a novel microwave-assisted one-pot tandem de-tert-butylation of tert-butyl amine in an Ugi-type multicomponent reaction product, tert-butyl isocyanide as a useful convertible i... |
Synonyms
| EINECS 230-553-5 |
| tert-butylisocyanide |
| t-butylisocyanide |
| Tert-Butyl isocyanide |
| tert-Butylisonitrile |
| Propane, 2-isocyano-2-methyl- |
| t-Butylisonitrile |
| 2-Isocyano-2-Methyl-Propane |
| .tert.-Butylisocyanide |
| 2-Methyl-2-isocyanopropane |
| MFCD00000002 |
| 2-Isocyano-2-methylpropane |
| t-butyl isocyanide |
