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CAS Number: 27737-55-9
ethyl 4-(benzyloxy)-1H-indole-2-carboxylate

Structure

ethyl 4-(benzyloxy)-1H-indole-2-carboxylate
Name: ethyl 4-(benzyloxy)-1H-indole-2-carboxylate
Synonyms:
General Information
Product Number: 27737559

CAS Registry Number 27737-55-9
Name:
1H-​Indole-​2-​carboxylic acid, 4-​(phenylmethoxy)​-​, ethyl ester
Indole-2-carboxylic acid, 4-(benzyloxy)-, ethyl ester (8CI)
4-Benzyloxy-1H-indole-2-carboxylic acid ethyl ester
Ethyl 4-benzyloxyindole-2-carboxylate

 

Chemical Formula: C18H17NO3
Exact Mass: 295.12
Molecular Weight: 295.33
m/z: 295.12 (100.0%), 296.12 (19.8%), 297.13 (2.5%)

 

InChI:InChI=1S/C18H17NO3/c1-2-21-18(20)16-11-14-15(19-16)9-6-10-17(14)22-12-13-7-4-3-5-8-13/h3-11,19H,2,12H2,1H3

InChI Key:HIQPISGKBJHKIN-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CC2=C(N1)C=CC=C2OCC3=CC=CC=C3

 

Thermal Properties Value Condition Note
Melting Point 170-172 °C Solv: ethyl acetate (141-78-6); hexane (110-54-3) (1)CAS
Melting Point 169-172 °C Solv: chloroform (67-66-3); hexane (110-54-3) (2)CAS

Specification

98%

References
  1. (1) Al-Said, Naim H.; Molecules 2005, V10(12), P1446-1457 CAPLUS
  2. (2) Sheng, Chunquan; European Journal of Medicinal Chemistry 2010, V45(9), P3531-3540 CAPLUS
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