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CAS Number: 14741-71-0
ethyl 2-(1H-benzo[d]imidazol-2-yl)acetate

Structure

ethyl 2-(1H-benzo[d]imidazol-2-yl)acetate
Name: ethyl 2-(1H-benzo[d]imidazol-2-yl)acetate
Synonyms:
General Information
Product Number: 14741710
CAS Registry Number: 14741-71-0
Name:
        1H-​Benzimidazole-​2-​acetic acid, ethyl ester
        2-​Benzimidazoleacetic acid, ethyl ester (6CI,​7CI,​8CI); 2-​(Ethoxycarbonylmethy​l)​benzimidazole; Ethyl 1H-​benzimidazole-​2-​acetate; Ethyl 2-​(2-​benzimidazolyl)​acetate; Ethyl 2-​benzimidazoleacetate; Ethyl 2-​benzimidazolylacetat​e; NSC 207854 
 
Chemical Formula: C11H12N2O2
Exact Mass: 204.09
Molecular Weight: 204.23
m/z: 204.09 (100.0%), 205.09 (12.7%)
Elemental Analysis: C, 64.69; H, 5.92; N, 13.72; O, 15.67
 
InChI: InChI=1S/C11H12N2O2/c1-2-15-11(14)7-10-12-8-5-3-4-6-9(8)13-10/h3-6H,2,7H2,1H3,(H,12,13)
InChIKey: JTVPWPDLKUQDAU-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)CC1=NC2=CC=CC=C2N1
 
hermal Properties Value Condition Note
Melting Point 128.5-129.5 °C   (4)CAS
Melting Point 128-129 °C Solv: ethyl acetate (141-78-6); ligroine (8032-32-4) (2)CAS
Melting Point 126-128 °C   (5)CAS
Melting Point 126-128 °C   (6)CAS
 

Specification

98%

References
  1. (1) Yan, Xu-xiu; Shanxi Daxue Xuebao, Ziran Kexueban 2003, V26(1), P49-51 CAPLUS
  2. (2) Chen, Wei; Chinese Journal of Structural Chemistry 2010, V29(8), P1241-1249 CAPLUS
  3. (3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  4. (4) Copeland, Ralph A. B.; Journal of the American Chemical Society 1943, V65, P1072-5 CAPLUS
  5. (5) Kakimoto, Shichiro; Nippon Kagaku Zasshi 1956, V77, P480-2 CAPLUS
  6. (6) Dubey, P. K.; Indian Journal of Heterocyclic Chemistry 2006, V16(2), P131-134 CAPLUS
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