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CAS Number: 245-08-9
5H-pyrido[3,2-b]indole

Structure

5H-pyrido[3,2-b]indole
Name: 5H-pyrido[3,2-b]indole
Synonyms:
General Information
Product Number: 245089

CAS Registry Number 245-08-9
Name:
5H-​Pyrido[3,​2-​b]​indole
δ-Carboline

 

Chemical Formula: C11H8N2
Exact Mass: 168.07
Molecular Weight: 168.19
m/z: 168.07 (100.0%), 169.07 (12.6%)

 

InChI:InChI=1S/C11H8N2/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7,13H

InChI Key:NSBVOLBUJPCPFH-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C3=C(N2)C=CC=N3

 

Thermal Properties Value Condition Note
Melting Point 225 °C   (3)CAS
Melting Point 207-208 °C Solv: benzene (71-43-2) (4)CAS
Melting Point 206-207 °C   (5)CAS
Melting Point 198.5 °C Solv: benzene (71-43-2) (6)CAS
Melting Point 197-198 °C   (7)CAS

Specification

98%

References

(3) Spath, Ernst; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1940, V73B, P719-23 CAPLUS
(4) Abramovitch, R. A.; Canadian Journal of Chemistry 1962, V40, P864-9 CAPLUS
(5) Mazu, Tryphon K.; European Journal of Medicinal Chemistry 2011, V46(6), P2378-2385 CAPLUS
(6) Kermack, William Ogilvy; Journal of the Chemical Society, Transactions 1921, V119, P1602-42 CAPLUS
(7) Spath, Ernst; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1930, V63B, P2102-11 CAPLUS

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