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Merck
CN

80150

Phthalonitrile

puriss., ≥99.0% (GC)

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About This Item

Linear Formula:
C6H4(CN)2
CAS Number:
Molecular Weight:
128.13
EC Number:
202-044-8
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
775028
MDL number:
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grade

puriss.

assay

≥99.0% (GC)

mp

137-139 °C (lit.), 139-141 °C

solubility

benzene: 50 mg/mL, clear

SMILES string

N#Cc1ccccc1C#N

InChI

1S/C8H4N2/c9-5-7-3-1-2-4-8(7)6-10/h1-4H

InChI key

XQZYPMVTSDWCCE-UHFFFAOYSA-N

Other Notes

Precursor of the appropriate amidate

pictograms

Skull and crossbones

signalword

Danger

hcodes

Hazard Classifications

Acute Tox. 3 Oral - Aquatic Chronic 3

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 1

flash_point_f

323.6 °F - closed cup

flash_point_c

162 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

Regulatory Information

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M.J. Hunter et al.
Journal of the American Chemical Society, 84, 3491-3491 (1962)
A P Kumar et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 53A(12), 2033-2039 (1998-01-23)
A zero-order normal coordinate analysis was made for p-, m- and o-dicyanobenzenes and their deuterated isomers by transferring the force constants from Part I. The observed and calculated frequencies agree with an average error of 18.7 cm-1, demonstrating the transferability
Juan Huang et al.
Guang pu xue yu guang pu fen xi = Guang pu, 29(1), 207-210 (2009-04-24)
In decades, metallo-phthalocyanines (MPcs) have undergone a renaissance because of their singular and unconventional physical properties. However, for the successful application of MPcs in practical devices, it is important to disperse MPc molecules into solid state matrix to fabricate MPc
An estimation of the sublimation rate of o-phthalodinitrile and acrylamide during filter sampling.
S Kanno
Industrial health, 23(2), 167-170 (1985-01-01)
J Pukkila et al.
The Analyst, 114(9), 1009-1012 (1989-09-01)
A method for the determination of emissions in workroom air as a result of the thermal degradation of polyester coating powders is described. The method is based on the determination of certain marker compounds only. Polyester coating powders were degraded

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