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3-Acetylisoquinoline
[CAS# 91544-03-5]

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Identification
Name 3-Acetylisoquinoline
Synonyms 3-Isoquinolinecarboxylic Acid; 3-Acetylisoquinoline; Sdccgmls-0065934.P001
Molecular Formula C10H7NO2
Molecular Weight 173.17
CAS Registry Number 91544-03-5
SMILES C1=C2C(=CN=C1C(O)=O)C=CC=C2
InChI 1S/C10H7NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H,12,13)
InChIKey KVMMIDQDXZOPAB-UHFFFAOYSA-N
Properties
Density 1.339g/cm3 (Cal.)
Melting point 167°C (Expl.)
Boiling point 366.442°C at 760 mmHg (Cal.)
Flash point 175.418°C (Cal.)
Safety Data
Safety Description R 36/37/38 S 26-36/37
SDS Available
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