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CAS Number: 56999-62-3
ethyl 2-(1-methyl-1H-indol-3-yl)acetate

Structure

ethyl 2-(1-methyl-1H-indol-3-yl)acetate
Name: ethyl 2-(1-methyl-1H-indol-3-yl)acetate
Synonyms:
General Information
Product Number: 56999623

CAS Registry Number 56999-62-3
Name:
1H-?Indole-?3-?acetic acid, 1-?methyl-?, ethyl ester
Indole-3-acetic acid, 1-methyl-, ethyl ester (6CI,7CI)
(1-Methyl-1H-indol-3-yl)acetic acid ethyl ester
Ethyl (1-methylindol-3-yl)acetate
NSC 165219

 

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/c1-3-16-13(15)8-10-9-14(2)12-7-5-4-6-11(10)12/h4-7,9H,3,8H2,1-2H3

InChI Key:OGNCQOCRWWFARG-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)CC1=CN(C2=CC=CC=C21)C

 

Thermal Properties Value Condition Note
Boiling Point 165 °C Press: 1 Torr (1)CAS
Boiling Point 155-160 °C Press: 0.4 Torr (2)CAS
Boiling Point 130-150 °C Press: 0.1 Torr (3)CAS
Boiling Point 130-150 °C Press: 0.2 Torr (4)IC
Boiling Point 120 °C Press: 0.095 Torr (5)IC

Specification

98%

References
  1. (1) King, Frederick E.; Journal of the Chemical Society 1934, P1901-5 CAPLUS
  2. (2) Bullock, Milon W.; Journal of the American Chemical Society 1951, V73, P5155-7 CAPLUS
  3. (3) Eiter, K.; Monatshefte fuer Chemie 1952, V83, P1453-76 CAPLUS
  4. (4) Alemany, A.; Anales de Quimica (1968-1979) 1974, V70(12), P1102-8 CAPLUS
  5. (5) Kikugawa, Yasuo; Synthesis 1981, (6), P461-2 CAPLUS
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