Benzoic acid,2-methyl-, 1,1-dimethylethyl ester

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Names

[ CAS No. ]:
16537-18-1

[ Name ]:
Benzoic acid,2-methyl-, 1,1-dimethylethyl ester

[Synonym ]:
o-toluic acid t-butyl ester
tert-butyl o-methylbenzoate
2-Methylbenzoesaeure-tert.-butylester

Chemical & Physical Properties

[ Density]:
0.995g/cm3

[ Boiling Point ]:
247.6ºC at 760 mmHg

[ Molecular Formula ]:
C12H16O2

[ Molecular Weight ]:
192.25400

[ Flash Point ]:
107.9ºC

[ Exact Mass ]:
192.11500

[ PSA ]:
26.30000

[ LogP ]:
2.95030

[ Vapour Pressure ]:
0.0254mmHg at 25°C

[ Index of Refraction ]:
1.498

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • O-Toluoylchloride
  • tert-Butanol
  • 4-Iodotoluene
  • carbon monoxide
  • potassium t-butoxide
  • Di-tert-butyl dicarbonate
  • tolylboronic acid
  • tert-Butyl 2-bromobenzoate
  • methyl iodide
  • Di-tert-butyl peroxide

DownStream

  • tert-butyl 2-(bromomethyl)benzoate
  • 2-Methylbenzoic acid

Related Compounds

  • Benzoic acid, 2-Methyl-6-nitro-, 1,1-dimethylethyl ester
  • Benzoic acid, 2-amino-3-methyl-, 1,1-dimethylethyl ester (9CI)
  • Benzoic acid, 5-amino-2-methyl-, 1,1-dimethylethyl ester (9CI)
  • tert-butyl 2-methyl-4-nitrobenzoate
  • tert-butyl 2-methyl-5-nitrobenzoate
  • 2-Methyl-2-propanyl 4-amino-2-methylbenzoate