Di-tert-butyl dicarbonate
ALDRICH/361941 - ReagentPlus®, ≥99%
Synonym: Boc anhydride; Di-tert-butyl pyrocarbonate
CAS Number: 24424-99-5
Empirical Formula (Hill Notation): C10H18O5
Molecular Weight: 218.25
EC Number: 246-240-1
MDL Number: MFCD00008805
Linear Formula: [(CH3)3COCO]2O
Product Type: Chemical
| application(s) | peptide synthesis |
| assay | ≥99% |
| bp | 56-57 °C/0.5 mmHg (lit.) |
| density | 0.95 g/mL at 25 °C (lit.) |
| form | solid or liquid |
| InChI | 1S/C10H18O5/c1-9(2,3)14-7 |
| InChI key | DYHSDKLCOJIUFX-UHFFFAOYSA |
| mp | 23 °C (lit.) |
| product line | ReagentPlus® |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | CC(C)(C)OC(=O)OC(=O)OC(C) |
| storage temp. | 2-8°C |
| Application: | Automated Boc protection and deprotection can be done using Synple Automated Synthesis Platform (SYNPLE-SC002 ), Boc protection cartridges ((SYNPLE-B001 ), (SYNPLE-B002 ), and Boc deprotection cartridges (SYNPLE-B011 ) |
| Application: | Di-tert-butyl dicarbonate (Boc anhydride) can be used: • As a reagent to introduce Boc protecting group for the amine functionalities. • To prepare tert-butyl ethers and Boc-alcohols in presence of Lewis acid catalyst. • As a carboxylating agent for the preparation of a variety of tert-butyl carboxylates. • For the conversion of amines to corresponding isocyanates, carbamates and urea derivatives. • As a coupling reagent for anchoring various carboxylic acids to hydroxymethylated resins. • To synthesize quinolinones and 2-(pseudo)haloquinolines from 2-alkenylanilines in presence of DMAP as a catalyst. |
| Application: | Reagent for the introduction of the Boc protecting group. |
| Legal Information: | ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany |
| Packaging: | 5, 25 g in poly bottle |
| Warning: | Hydrolyzes to t-butanol and CO2; causes internal pressure in bottle if exposed to moisture. |
| Symbol |    GHS02,GHS05,GHS06 |
| Signal word | Danger |
| Hazard statements | H226 - H315 - H317 - H318 - H330 - H335 |
| Precautionary statements | P210 - P233 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 |
| Hazard Codes | T+ |
| Risk Statements | 10-26-36/37/38-43 |
| Safety Statements | 7/9-16-26-28-36/37/39-45 |
| RIDADR | UN 2929 3(6.1) / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 98.6 °F - closed cup |
| Flash Point(C) | 37 °C - closed cup |
| Purity | ≥99% |
| bp | 56-57 °C/0.5 mmHg (lit.) |
| mp | 23 °C (lit.) |
| Density | 0.95 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 12352302 |