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CAS Number: 20127-61-1
1-ethyl-9H-pyrido[3,4-b]indole

Structure

 1-ethyl-9H-pyrido[3,4-b]indole
Name: 1-ethyl-9H-pyrido[3,4-b]indole
Synonyms:
General Information
Product Number: 20127611

CAS Registry Number 20127-61-1
Name:
9H-?Pyrido[3,?4-?b]?indole, 1-?ethyl-
1-Ethyl-β-carboline

 

Chemical Formula: C13H12N2
Exact Mass: 196.10
Molecular Weight: 196.25
m/z: 196.10 (100.0%), 197.10 (14.8%)

 

InChI:InChI=1S/C13H12N2/c1-2-11-13-10(7-8-14-11)9-5-3-4-6-12(9)15-13/h3-8,15H,2H2,1H3

InChI Key:YTQRHYCHEIXUIU-UHFFFAOYSA-N

Canonical SMILES:CCC1=NC=CC2=C1NC3=CC=CC=C23

 

Thermal Properties Value Condition Note
Melting Point 195-196 °C   (4)CAS
Melting Point 193 °C   (8)CAS
Melting Point 192-195 °C Solv: acetone (67-64-1); ligroine (8032-32-4) (3)CAS
Melting Point 192-194 °C   (2)CAS
Melting Point 41-42 °C   (9)CAS
Melting Point See full text   (7)CAS

Specification

98%
References
  1. (2) Li, Shengkun; Natural Product Communications 2010, V5(10), P1591-1596 CAPLUS
  2. (3) Wu, Mengde; Synthesis 2010, (4), P587-592 CAPLUS
  3. (4) Dong, Jing; European Journal of Organic Chemistry 2010, (36), P6987-6992, S6987/1-S6987/77 CAPLUS
  4. (7) Ivanov, Iliyan; Heterocycles 2005, V65(10), P2483-2492 CAPLUS
  5. (8) Jordaan, A.; Journal of the South African Chemical Institute 1968, V21(1), P22-5 CAPLUS
  6. (9) Leonard, Nelson J.; Journal of Organic Chemistry 1942, V7, P556-72 CAPLUS
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