中文版English

CAS Number: 203866-13-1
(2S,4S)-1-(tert-butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid

Structure

(2S,4S)-1-(tert-butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid
Name: (2S,4S)-1-(tert-butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid
Synonyms:
General Information
Product Number: 203866131

CAS Registry Number: 203866-13-1

Name:

1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​fluoro-​, 1-​(1,​1-​dimethylethyl) ester, (2S,​4S)​-
1,​2-​Pyrrolidinedicarboxy​lic acid, 4-​fluoro-​, 1-​(1,​1-​dimethylethyl) ester, (2S-​cis)​-; (2S,​4S)​-​1-​(tert-​Butoxycarbonyl)​-​4-​fluoro-​2-​pyrrolidinecarboxyli​c acid; (2S,​4S)​-​1-​(tert-​Butoxycarbonyl)​-​4-​fluoropyrrolidine-​2-​carboxylic acid; (2S,​4S)​-​1-​(tert-​Butoxycarbonyl)​-​4-​fluoropyrrolidine-​2-​carboxylic acid; (2S,​4S)​-​1-​(tert-​Butoxycarbonyl)​-​4-​fluoropyrrolidine-​2-​carboxylicaci; (4S)​-​1-​tert-​Butoxycarbonyl-​4-​fluoro-​L-​proline; N-​tert-​BOC-​cis-​4-​fluoro-​L-​proline 

Deleted CAS Registry Numbers: 1266242-​44-​7

 

Chemical Formula: C10H16FNO4
Exact Mass: 233.11
Molecular Weight: 233.24
m/z: 233.11 (100.0%), 234.11 (11.2%), 235.11 (1.4%)
Elemental Analysis: C, 51.50; H, 6.91; F, 8.15; N, 6.01; O, 27.44

 

InChI: InChI=1S/C10H16FNO4/c1-10(2,3)16-9(15)12-5-6(11)4-7(12)8(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)/t6-,7-/m0/s1
InChIKey: YGWZXQOYEBWUTH-BQBZGAKWSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1CC(CC1C(=O)O)F
Isomeric SMILES: CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)O)F

 

Thermal Properties Value Condition Note
Melting Point 160-162 °C   (2)CAS

Specification

98%

References
  1. (1) Hodges, Jonathan A.; Journal of the American Chemical Society 2003, V125(31), P9262-9263 CAPLUS
  2. (2) Chiba, Jun; Bioorganic & Medicinal Chemistry 2006, V14(8), P2725-2746 CAPLUS
  3. (3) Haffner, Curt Dale; WO 2003002531 A2 2003 CAPLUS
  4. (4) Haffner, Curt Dale; WO 2003002553 A2 2003 CAPLUS
  5. (5) Staas, Donnette D.; WO 2004032834 A2 2004 CAPLUS
Contact Us
TEL:  86-17758012822
FAX:  86-571-87759731
E-mail:sales@hzchempro.com
[ CLOSE ]