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Home >> Chemical Listing >> Page 281 >> 2-(2-Propyn-1-Yl)-1(2H)-Isoquinolinone

2-(2-Propyn-1-Yl)-1(2H)-Isoquinolinone
[CAS# 125030-80-0]

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Identification
Name 2-(2-Propyn-1-Yl)-1(2H)-Isoquinolinone
Synonyms 2-(prop-2-yn-1-yl)isoquinolin-1(2H)-one
Molecular Structure CAS#: 125030-80-0, 2-(2-Propyn-1-Yl)-1(2H)-Isoquinolinone
Molecular Formula C12H9NO
Molecular Weight 183.21
CAS Registry Number 125030-80-0
SMILES O=C1c2ccccc2\C=C/N1CC#C
InChI 1S/C12H9NO/c1-2-8-13-9-7-10-5-3-4-6-11(10)12(13)14/h1,3-7,9H,8H2
InChIKey KOZJGHVVRNSSIZ-UHFFFAOYSA-N
Properties
Density 1.182g/cm3 (Cal.)
Boiling point 343.373°C at 760 mmHg (Cal.)
Flash point 163.002°C (Cal.)
Refractive index 1.607 (Cal.)
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