| Identification | Back Directory | [Name]
1-Pyrrolidinecarboxylicacid,3-amino-4-hydroxy-,1,1-dimethylethylester(9CI) | [CAS]
190141-99-2 | [Synonyms]
1-BOC-3-AMINO-4-HYDROXY-PYRROLIDINE
tert-Butyl 3-aMino-4-hydroxypyrrolidine-1-carboxylate
tert-Butyl 3-amino-4-hydroxy-1-pyrrolidinecarboxylate
2-Methyl-2-propanyl 3-amino-4-hydroxy-1-pyrrolidinecarboxylate
3-Amino-4-hydroxy-1-pyrrolidinecarboxylic acid tert-butyl ester
1-Pyrrolidinecarboxylicacid,3-amino-4-hydroxy-,1,1-dimethyle...
1-Pyrrolidinecarboxylic acid, 3-aMino-4-hydroxy-, 1,1-diMethylethyl ester
1-Pyrrolidinecarboxylicacid,3-amino-4-hydroxy-,1,1-dimethylethylester(9CI)
[trans-]-3-amino-4-hydroxy-1-pyrrolidinecarboxylic acid 1,1-dimethylethyl ester
3-Amino-4-Hydroxy-Pyrrolidine-1-Carboxylic Acid Tert-Butyl Ester(Mixture Of Cis&Trans) | [Molecular Formula]
C9H18N2O3 | [MDL Number]
MFCD14705159 | [MOL File]
190141-99-2.mol | [Molecular Weight]
202.25 |
| Chemical Properties | Back Directory | [Boiling point ]
309℃ | [density ]
1.179 | [Fp ]
141℃ | [storage temp. ]
under inert gas (nitrogen or Argon) at 2–8 °C | [pka]
14.36±0.40(Predicted) | [Appearance]
White to off-white Solid | [InChI]
InChI=1S/C9H18N2O3/c1-9(2,3)14-8(13)11-4-6(10)7(12)5-11/h6-7,12H,4-5,10H2,1-3H3 | [InChIKey]
MOZOQDNRVPHFOO-UHFFFAOYSA-N | [SMILES]
N1(C(OC(C)(C)C)=O)CC(O)C(N)C1 |
| Hazard Information | Back Directory | [Synthesis]
The general procedure for the synthesis of tert-butyl 3-amino-4-hydroxy-1-pyrrolidinecarboxylate from 3-N-tert-butoxycarbonyl-6-oxa-3-azabicyclo[3.1.0]hexane is as follows: tert-butyl 6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate (20 g, 0.11 mol) was mixed with ammonia (200 mL) and heated under reflux conditions to react Overnight. After completion of the reaction, the reaction mixture was concentrated in vacuum to afford the target product tert-butyl 3-amino-4-hydroxypyrrolidine-1-carboxylate (21 g, 96% yield) as a light yellow oil.1H NMR (400 MHz, CDCl3) data were as follows: δ 3.98-3.97 (m, 1H), 3.75-3.61 (m, 2H), 3.36- 3.22 (m, 2H), 3.08-3.17 (m, 1H), 1.45 (s, 9H). | [References]
[1] Patent: WO2010/114971, 2010, A1. Location in patent: Page/Page column 153
[2] Bioorganic and Medicinal Chemistry Letters, 1998, vol. 8, # 3, p. 221 - 226
[3] Patent: WO2004/108661, 2004, A1. Location in patent: Page/Page column 48-49
[4] Patent: WO2005/28454, 2005, A1. Location in patent: Page/Page column 50-51
[5] Patent: WO2004/838, 2003, A1. Location in patent: Page 71 |
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