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CAS Number: 20922-03-6
1-isopropylisoquinoline

Structure

1-isopropylisoquinoline
Name: 1-isopropylisoquinoline
Synonyms:
General Information
Product Number: 20922036
CAS Registry Number: 20922-03-6
Name:
Isoquinoline, 1-​(1-​methylethyl)​-
Isoquinoline, 1-​isopropyl- (8CI); 1-​Isopropylisoquinolin​e 
 
Chemical Formula: C12H13N
Exact Mass: 171.10
Molecular Weight: 171.24
m/z: 171.10 (100.0%), 172.11 (13.1%)
Elemental Analysis: C, 84.17; H, 7.65; N, 8.18
 
InChI: InChI=1S/C12H13N/c1-9(2)12-11-6-4-3-5-10(11)7-8-13-12/h3-9H,1-2H3
InChIKey: FMJXFOQSCMCXGZ-UHFFFAOYSA-N
Canonical SMILES : CC(C)C1=NC=CC2=CC=CC=C21
 
Thermal Properties Value Condition Note
Boiling Point 135 °C Press: 30 Torr (1)IC

Specification

98%

References
  1. (1) Ferles, Miloslav; Collection of Czechoslovak Chemical Communications 1981, V46(1), P262-5 CAPLUS
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