Tert-Butyl 4-Nitrophenyl Carbonate
[CAS# 13303-10-1]

Identification

• Name: Tert-Butyl 4-Nitrophenyl Carbonate
• Synonyms: Carbonic Acid Tert-Butyl (4-Nitrophenyl) Ester; Tert-Butyl P-Nitrophenyl Carbonate; Carbonic Acid, 1,1-Dimethylethyl 4-Nitrophenyl Ester
• Molecular Formula: C₁₁H₁₃NO₅
• Molecular Weight: 239.23
• CAS Registry Number: 13303-10-1
• EINECS: 236-328-8
• SMILES: C1=C(OC(OC(C)(C)C)=O)C=CC(=C1)[N+](=O)[O-]
• InChI: 1S/C11H13NO5/c1-11(2,3)17-10(13)16-9-6-4-8(5-7-9)12(14)15/h4-7H,1-3H3
• InChIKey: XNPGBDJTEBCMHA-UHFFFAOYSA-N

Properties

• Density: 1.228g/cm³ (Cal.)
• Boiling point: 345.716°C at 760 mmHg (Cal.)
• Flash point: 147.779°C (Cal.)

References

• (1): Syed Nawazish Ali, Sabira Begum, Mitchell A. Winnik and Alan J. Lough . 2,5-Dimethylhexane-2,5-diyl bis(4-nitrophenyl) dicarbonate , Acta Cryst (2008). E64, o694Â Â