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757209

Sigma-Aldrich

3-Phenylisoquinoline

97%

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About This Item

Empirical Formula (Hill Notation):
C15H11N
CAS Number:
37993-76-3
Molecular Weight:
205.25
MDL number:
MFCD00179548
UNSPSC Code:
12352103
PubChem Substance ID:
329766656
NACRES:
NA.23

Assay

97%

form

powder or crystals

mp

100-105 °C

SMILES string

c1ccc(cc1)-c2cc3ccccc3cn2

InChI

1S/C15H11N/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-16-15/h1-11H

InChI key

RBJOTRVJJWIIER-UHFFFAOYSA-N

General description

3-phenylisoquinoline can be prepared by the Bradsher procedure. It is an important component in the essential oils obtained from Ageratum conyzoides. 2

Application

This material can be used as a ligand to synthesize a variety of OLED dopants.

Pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

Signal Word

Danger

Hazard Statements

H302,H311,H315,H318

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MKBJ9025

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An unexpected product during synthesis of 3-phenylisoquinoline: Improved preparation of 4-hydroxy-3-phenylisoquinoline
Sard H
Journal of Heterocyclic Chemistry, 1085-1087 null
An unexpected product during synthesis of 3-phenylisoquinoline: Improved preparation of 4-hydroxy-3-phenylisoquinoline
Sard H
Journal of Heterocyclic Chemistry null

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