ChemicalBook--->CAS DataBase List--->369638-68-6

369638-68-6

369638-68-6 Structure

369638-68-6 Structure
IdentificationBack Directory
[Name]

Carbamic acid, (5-methylpyrazinyl)-, 1,1-dimethylethyl ester (9CI)
[CAS]

369638-68-6
[Synonyms]

pyrazin-2-yL
2-Boc-Amino-5-methylpyrazine
2-N-Boc-aMino-5-Methylpyrazin
1,1-diMethylethyl ester (9CI)
N-Boc-2-amino-5-methylpyrazine
tert-butyl N-(5-Methylpyrazin-2-yl)carbaMate
CarbaMic acid,N-(5-Methyl-2-pyrazinyl)-, 1,1-diMethylethyl ester
Carbamic acid, (5-methylpyrazinyl)-, 1,1-dimethylethyl ester (9CI)
[EINECS(EC#)]

200-589-5
[Molecular Formula]

C10H15N3O2
[MDL Number]

MFCD09907674
[MOL File]

369638-68-6.mol
[Molecular Weight]

209.245
Chemical PropertiesBack Directory
[Boiling point ]

268.8±40.0 °C(Predicted)
[density ]

1.154±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Store in freezer, under -20°C
[pka]

11.63±0.70(Predicted)
[Appearance]

White to light yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

Carbamic acid, (5-methylpyrazinyl)-, 1,1-dimethylethyl ester (9CI)(369638-68-6)1HNMR
Hazard InformationBack Directory
[Synthesis]

5-Methyl-2-pyrazinecarboxylic acid

5521-55-1

tert-Butanol

75-65-0

Carbamic acid, (5-methylpyrazinyl)-, 1,1-dimethylethyl ester (9CI)

369638-68-6

5-Methylpyrazine-2-carboxylic acid (13.81 g, 0.1 mol), tert-butanol (95 mL, 1 mol), triethylamine (27.9 mL, 0.2 mol) and diphenylphosphoryl azide (30.27 g, 0.11 mol) were dissolved in 300 mL of toluene. The reaction mixture was heated to reflux temperature for 8 hours. Upon completion of the reaction, the product was purified by silica gel column chromatography with petroleum ether-ethyl acetate (20:1, v/v) as eluent to afford 15.2 g of N-Boc-2-amino-5-methylpyrazine as a pale yellow solid in 72.7% yield.

[References]

[1] Bioorganic and Medicinal Chemistry Letters, 2006, vol. 16, # 14, p. 3751 - 3754
[2] Bioorganic and Medicinal Chemistry Letters, 2005, vol. 15, # 18, p. 4136 - 4142
[3] Patent: EP2781508, 2014, A1. Location in patent: Paragraph 0153
[4] Bioorganic and Medicinal Chemistry Letters, 2002, vol. 12, # 8, p. 1203 - 1208
[5] Patent: WO2011/90738, 2011, A2. Location in patent: Page/Page column 45
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