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CAS Number: 37033-94-6
ethyl 5-ethyl-1H-indole-2-carboxylate

Structure

 ethyl 5-ethyl-1H-indole-2-carboxylate
Name: ethyl 5-ethyl-1H-indole-2-carboxylate
Synonyms:
General Information
Product Number: 37033946

CAS Registry Number 37033-94-6
Name:
1H-?Indole-?2-?carboxylic acid, 5-?ethyl-?, ethyl ester
NSC 111163

 

Chemical Formula: C13H15NO2
Exact Mass: 217.11
Molecular Weight: 217.26
m/z: 217.11 (100.0%), 218.11 (14.5%)

 

InChI:InChI=1S/C13H15NO2/c1-3-9-5-6-11-10(7-9)8-12(14-11)13(15)16-4-2/h5-8,14H,3-4H2,1-2H3

InChI Key:BPAHRSSJFSVBFO-UHFFFAOYSA-N

Canonical SMILES:CCC1=CC2=C(C=C1)NC(=C2)C(=O)OCC

 

Thermal Properties Value Condition Note
Boiling Point 155.7 °C Press: 0.4 Torr (1)CAS
Melting Point 103 °C Solv: benzene (71-43-2) (1)CAS

Specification

98%
References

(1) Prelog, V.; Helvetica Chimica Acta 1948, V31, P1178-82 CAPLUS
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