tert-Butyl nitrite
ALDRICH/235385 - 90%
Synonym: 1,1-Dimethylethyl nitrite
CAS Number: 540-80-7
Empirical Formula (Hill Notation): C4H9NO2
Molecular Weight: 103.12
EC Number: 208-757-0
MDL Number: MFCD00002055
Linear Formula: (CH3)3CONO
Product Type: Chemical
| assay | 90% |
| bp | 61-63 °C (lit.) |
| density | 0.867 g/mL at 25 °C (lit.) |
| functional group | nitroso |
| O-nitroso | |
| InChI | 1S/C4H9NO2/c1-4(2,3)7-5-6 |
| InChI key | IOGXOCVLYRDXLW-UHFFFAOYSA |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | CC(C)(C)ON=O |
| solubility | alcohol: very soluble(lit.) |
| carbon disulfide: very soluble(lit.) | |
| chloroform: very soluble(lit.) | |
| diethyl ether: very soluble(lit.) | |
| glycerol: insoluble (practically)(lit.) | |
| water: slightly soluble(lit.) | |
| storage temp. | 2-8°C |
| Application: | tert-Butyl nitrite has been used as reagent: • for diazotization and nitrosation of alcohols, thiols, amines and cycloalkanes • for the preparation of aryl azides from aryl amines |
| General description: | tert-Butyl nitrite (TBN) is an efficient NO source. TBN participates in photocatalyzed conversion of aryl- and heteroarylamines to selenides. It also participates in radical multifunctionalization reactions of aliphatic alkenes. |
| Other Notes: | remainder 2-methyl-2-propanol |
| Packaging: | 25, 100 mL in glass bottle |
| Symbol |   GHS02,GHS07 |
| Signal word | Danger |
| Hazard statements | H225 - H302 + H332 |
| Precautionary statements | P210 - P301 + P312 + P330 - P304 + P340 + P312 |
| Hazard Codes | F,Xn |
| Risk Statements | 11-20/22 |
| Safety Statements | 16-24-46 |
| RIDADR | UN 2351 3 / PGII |
| WGK Germany | WGK 1 |
| Flash Point(F) | 14.0 °F - closed cup |
| Flash Point(C) | -10 °C - closed cup |
| Purity | 90% |
| bp | 61-63 °C (lit.) |
| Density | 0.867 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 12352100 |