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CAS Number: 15574-49-9
ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate

Structure

ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
Name: ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
Synonyms:
General Information
Product Number: 15574499

CAS Registry Number 15574-49-9
Name:
1H-?Indole-?3-?carboxylic acid, 5-?hydroxy-?1,?2-?dimethyl-?, ethyl ester
Indole-3-carboxylic acid, 5-hydroxy-1,2-dimethyl-, ethyl ester (6CI,7CI,8CI)
1,2-Dimethyl-3-carbethoxy-5-hydroxyindole
1,2-Dimethyl-3-carbethoxy-5-oxyindole
3-(Ethoxycarbonyl)-5-hydroxy-1,2-dimethylindole
Ba 2676

 

Chemical Formula: C13H15NO3
Exact Mass: 233.11
Molecular Weight: 233.26
m/z: 233.11 (100.0%), 234.11 (14.3%), 235.11 (1.6%)

 

InChI:InChI=1S/C13H15NO3/c1-4-17-13(16)12-8(2)14(3)11-6-5-9(15)7-10(11)12/h5-7,15H,4H2,1-3H3

InChI Key:YTBNTDMBGXAOCG-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C)C

 

Thermal Properties Value Condition Note
Melting Point 209-210 °C   (1)CAS
Melting Point 208-209 °C Solv: dichloromethane (75-09-2); acetone (67-64-1) (2)CAS
Melting Point 207-208 °C Solv: dichloromethane (75-09-2); acetone (67-64-1) (2)CAS
Melting Point 207-208 °C   (3)CAS
Melting Point 207-208 °C Solv: acetone (67-64-1) (4)CAS
Melting Point 206-207 °C Solv: dichloromethane (75-09-2); acetone (67-64-1) (2)CAS

Specification

98%

References
  1. (1) FR 5142 1967 CAPLUS
  2. (2) Velezheva, Valeriya S.; Journal of Heterocyclic Chemistry 2006, V43(4), P873-879 CAPLUS
  3. (3) Grinev, A. N.; Zhurnal Obshchei Khimii 1962, V32, P1948-51 CAPLUS
  4. (4) Grinev, A. N.; Zhurnal Obshchei Khimii 1955, V25, P1355-7 CAPLUS
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