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Ethyl Cyano(4-Isoquinolinyl)Acetate
[CAS# 117646-39-6]

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Identification
Name Ethyl Cyano(4-Isoquinolinyl)Acetate
Synonyms a-Cyano-4-isoquinolineacetic acid ethyl ester
Molecular Formula C14H12N2O2
Molecular Weight 240.26
CAS Registry Number 117646-39-6
SMILES CCOC(=O)C(C#N)c2cncc1ccccc12
InChI 1S/C14H12N2O2/c1-2-18-14(17)12(7-15)13-9-16-8-10-5-3-4-6-11(10)13/h3-6,8-9,12H,2H2,1H3
InChIKey WAKMXXMRJZAELC-UHFFFAOYSA-N
Properties
Density 1.221g/cm3 (Cal.)
Boiling point 433.15°C at 760 mmHg (Cal.)
Flash point 215.762°C (Cal.)
Refractive index 1.6 (Cal.)
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