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Empirical Formula (Hill Notation):
C16H11NO
CAS Number:
Molecular Weight:
233.26
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
Assay
98%
mp
76-79 °C (lit.)
SMILES string
O=C(c1ccccc1)c2nccc3ccccc23
InChI
1S/C16H11NO/c18-16(13-7-2-1-3-8-13)15-14-9-5-4-6-12(14)10-11-17-15/h1-11H
InChI key
MDWCIKACMBMJFA-UHFFFAOYSA-N
Related Categories
General description
1-Isoquinolinyl phenyl ketone (iquinpk) reacts with ReCl3(MeCN)(PPh3)] complex to give [ReCl3(N-O)(PPh3)]. It also reacts with the [ReOBr3(PPh3)2] complex in acetone to yield novel complex, [ReOBr2(iquinpk-OH)(PPh3)].
Application
1-Isoquinolinyl phenyl ketone may be used in chemical synthesis.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Certificates of Analysis (COA)
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Nucleophilic addition of water to 1-isoquinolinyl phenyl ketone. The synthesis, spectroscopic investigation, crystal and molecular structure and DFT calculations of [ReOBr2(iquinpk-OH)(PPh3)].
Machura,B, et al.
Inorganic Chemistry Communications, 12(8), 789-792 (2009)
Synthesis, spectroscopic characterization, X-ray structure and DFT calculations of rhenium (III) complex with 1-isoquinolinyl phenyl ketone.
Machura B, et al.
Polyhedron, 27(6), 1739-1746 (2008)
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