424013

1-(tert-Butoxycarbonyl)imidazole

97%

• Empirical Formula (Hill Notation): C₈H₁₂N₂O₂
• CAS Number: 49761-82-2
• Molecular Weight: 168.19
• EC Number: 256-475-1
• MDL number: MFCD00014497
• UNSPSC Code: 12352005
• PubChem Substance ID: 24866546
• NACRES: NA.22

Properties

• Assay: 97%
• bp: 147-150 °C (lit.)
• mp: 45-47 °C (lit.)
• SMILES string: CC(C)(C)OC(=O)n1ccnc1
• InChI: 1S/C8H12N2O2/c1-8(2,3)12-7(11)10-5-4-9-6-10/h4-6H,1-3H3
• InChI key: MTBKGWHHOBJMHJ-UHFFFAOYSA-N

Description

General description

1-(tert-butoxycarbonyl)imidazole is an imidazole derivative. Its gas-phase elimination kinetics study has been studied both theoretically and experimentally.

Application

1-(tert-butoxycarbonyl)imidazole was used in the preparation of water soluble polyrotaxane, via modification of α-cyclodextrin in the presence of KOH and N,N′-carbonyldiimidazole.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H315,H319,H335
• Precautionary Statements: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): 235.4 °F - closed cup
• Flash Point(C): 113 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves