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225029

4-Phenylbenzonitrile

Name: 4-Phenylbenzonitrile
Brand: ALDRICH

95%

Synonym(s):

4-Cyanobiphenyl, Biphenyl-4-carbonitrile

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About This Item

Linear Formula:

C₆H₅C₆H₄CN

CAS Number:

2920-38-9

Molecular Weight:

179.22

UNSPSC Code:

12352103

NACRES:

NA.23

PubChem Substance ID:

24853474

EC Number:

220-860-2

Beilstein/REAXYS Number:

1907924

MDL number:

MFCD00001821

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Properties

assay

95%

form

liquid crystal

impurities

5% 4-bromobiphenyl

mp

85-87 °C (lit.)

SMILES string

N#Cc1ccc(cc1)-c2ccccc2

InChI

1S/C13H9N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H

InChI key

BPMBNLJJRKCCRT-UHFFFAOYSA-N

Description

pictograms

GHS07

signalword

Warning

hcodes

H302 + H312 + H332

pcodes

P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

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

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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A molecular dynamics study of the nematic phase of 4-n-pentyl-4'-cyanobiphenyl.

Picken, S. J., Van Gunsteren, W. F., Duijnen, P. T. V., & De Jeu, W. H.

Liq. Cryst., 6(3), 357-371 (1989)

Angle of twist between the two rings of 4-cyanobiphenyl when dissolved in liquid-crystalline solvents

aDe Luca, G

J. Chem. Soc., Faraday, 88(12), 1679-1684 (1992)

Surface-enhanced Raman scattering of 4-cyanobiphenyl on gold and silver nanoparticle surfaces.

Joo, S. W., Chung, T. D., Jang, W. C., Gong, M. S., Geum, N., & Kim, K.

Langmuir, 18(23), 8813-8816 (2002)

Global Trade Item Number

SKU	GTIN
225029-10G	04061833595640