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CAS Number: 35296-53-8
1-methylpyrano[3,4-b]indol-3(9H)-one

Structure

 1-methylpyrano[3,4-b]indol-3(9H)-one
Name: 1-methylpyrano[3,4-b]indol-3(9H)-one
Synonyms:
General Information
Product Number: 35296538

CAS Registry Number 35296-53-8
Name:
Pyrano[3,?4-?b]?indol-?3(9H)?-?one, 1-?methyl-
Δ3,α-Indolineacetic acid, 2-(1-hydroxyethylidene)-, δ-lactone (6CI,7CI)
1-Methylpyrano[3,4-b]indol-3(9H)-one

 

Chemical Formula: C12H9NO2
Exact Mass: 199.06
Molecular Weight: 199.21
m/z: 199.06 (100.0%), 200.07 (13.2%), 201.07 (1.2%)

 

InChI:InChI=1S/C12H9NO2/c1-7-12-9(6-11(14)15-7)8-4-2-3-5-10(8)13-12/h2-6,13H,1H3

InChI Key:VTQRQCAOWIROBL-UHFFFAOYSA-N

Canonical SMILES:CC1=C2C(=CC(=O)O1)C3=CC=CC=C3N2

 

Thermal Properties Value Condition Note
Melting Point 260-262 °C (decomp)   (3)IC
Melting Point 226-227 °C   (4)CAS

Specification

98%
References
  1. (3) Moody, Christopher J.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1985, (11), P2505-8 CAPLUS
  2. (4) Tolkunov, S. V.; Chemistry of Heterocyclic Compounds (New York, NY, United States)(Translation of Khimiya Geterotsiklicheskikh Soedinenii) 2004, V40(4), P481-489 CAPLUS
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