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CAS Number: 102195-80-2
(S)-1-tert-butyl 2-methyl 4-oxopyrrolidine-1,2-dicarboxylate

Structure

(S)-1-tert-butyl 2-methyl 4-oxopyrrolidine-1,2-dicarboxylate
Name: (S)-1-tert-butyl 2-methyl 4-oxopyrrolidine-1,2-dicarboxylate
Synonyms:
General Information
Product Number: 102195802

CAS Registry Number: 102195-80-2

Name:

1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​oxo-​, 1-​(1,​1-​dimethylethyl) 2-​methyl ester, (2S)​-
1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​oxo-​, 1-​(1,​1-​dimethylethyl) 2-​methyl ester, (S)​-; (2S)​-​4-​Oxo-​1-​(tert-​butoxycarbonyl)​pyrrolidine-​2-​carboxylic acid methyl ester; 1-​tert-​Butyl 2-​methyl (2S)​-​4-​oxopyrrolidine-​1,​2-​dicarboxylate; tert-​Butyl (2S)​-​2-​(methoxycarbonyl)​-​4-​oxopyrrolidine-​1-​carboxylate 

 

Chemical Formula: C11H17NO5
Exact Mass: 243.11
Molecular Weight: 243.26
m/z: 243.11 (100.0%), 244.11 (12.5%), 245.11 (1.1%)
Elemental Analysis: C, 54.31; H, 7.04; N, 5.76; O, 32.89

 

InChI: InChI=1S/C11H17NO5/c1-11(2,3)17-10(15)12-6-7(13)5-8(12)9(14)16-4/h8H,5-6H2,1-4H3/t8-/m0/s1
InChIKey: UPBHYYJZVWZCOZ-QMMMGPOBSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC(=O)CC1C(=O)OC
Isomeric SMILES: CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)OC

Specification

98%

References
  1. (1) Honda, Toshio; Journal of Organic Chemistry 2005, V70(2), P499-504 CAPLUS
  2. (2) Barkallah, Salim; Tetrahedron Letters 2005, V46(30), P4985-4987 CAPLUS
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  4. (4) Pei, Zhonghua; WO 2005023762 A1 2005 CAPLUS
  5. (5) Patel, Dinesh V.; WO 2002102790 A1 2002 CAPLUS
  6. (6) Lewis, Jason G.; WO 2005012320 A2 2005 CAPLUS
  7. (7) Chiba, Jun; Bioorganic & Medicinal Chemistry 2006, V14(8), P2725-2746 CAPLUS
  8. (8) Kamal, Ahmed; Bioorganic & Medicinal Chemistry 2009, V17(4), P1557-1572 CAPLUS
  9. (9) Lewis, Jason G.; US 20050043248 A1 2005 CAPLUS
  10. (10) Tamaki, Makoto; Journal of Organic Chemistry 2001, V66(10), P3593-3596 CAPLUS
  11. (11) Lin, Linus S.; US 20020193399 A1 2002 CAPLUS
  12. (12) Staas, Donnette D.; WO 2004032834 A2 2004 CAPLUS
  13. (13) Qiu, Xiao-Long; Synthesis 2004, (3), P334-340 CAPLUS
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