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CAS Number: 39974-94-2
5-methoxy-1-methyl-1H-indole-3-carbaldehyde

Structure

5-methoxy-1-methyl-1H-indole-3-carbaldehyde
Name: 5-methoxy-1-methyl-1H-indole-3-carbaldehyde
Synonyms:
General Information
Product Number: 39974942

CAS Registry Number 39974-94-2
Name:
1H-?Indole-?3-?carboxaldehyde, 5-?methoxy-?1-?methyl-
1-Methyl-5-methoxyindole-3-carboxyaldehyde
5-Methoxy-1-methyl-1H-indole-3-carboxaldehyde
5-Methoxy-1-methyl-3-indolecarboxaldehyde

 

Chemical Formula: C11H11NO2
Exact Mass: 189.08
Molecular Weight: 189.21
m/z: 189.08 (100.0%), 190.08 (12.3%)

 

InChI:InChI=1S/C11H11NO2/c1-12-6-8(7-13)10-5-9(14-2)3-4-11(10)12/h3-7H,1-2H3

InChI Key:OFNAEHQJIMREFJ-UHFFFAOYSA-N

Canonical SMILES:CN1C=C(C2=C1C=CC(=C2)OC)C=O

 

Thermal Properties Value Condition Note
Melting Point 157-159 °C Solv: methanol (67-56-1) (1)CAS
Melting Point 134 °C Solv: ethanol (64-17-5) (5)IC
Melting Point 131-133 °C Solv: ethanol (64-17-5) (3)IC
Melting Point 128-130 °C Solv: ligroine (8032-32-4); dichloromethane (75-09-2) (2)CAS

Specification

98%

References
  1. (1) Dubey, P. K.; Green Chemistry Letters and Reviews 2010, V3(4), P257-261 CAPLUS
  2. (2) Chakrabarty, Manas; Tetrahedron 2005, V61(7), P1793-1801 CAPLUS
  3. (3) Reimann, Eberhard; Archiv der Pharmazie (Weinheim, Germany) 1988, V321(11), P823-6 CAPLUS
  4. (5) Bisagni, Emile; Heterocycles 1988, V27(7), P1671-8 CAPLUS
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