Skip to Content
Merck
All Photos(1)

Documents

270318

Supelco

Benzonitrile

suitable for HPLC, 99.9%

Synonym(s):

Phenyl cyanide

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
C6H5CN
CAS Number:
100-47-0
Molecular Weight:
103.12
Beilstein:
506893
EC Number:
202-855-7
MDL number:
MFCD00001770
UNSPSC Code:
12190000
eCl@ss:
39031505
PubChem Substance ID:
329752928
NACRES:
NA.21

Assay

99.9%

form

liquid

purified by

glass distillation

expl. lim.

0.34-6.3 %

technique(s)

HPLC: suitable

impurities

≤0.03% water

evapn. residue

<0.0005%

refractive index

n20/D 1.528 (lit.)

bp

191 °C (lit.)

mp

−13 °C (lit.)

λ

H2O reference

UV absorption

λ: 300 nm Amax: 1.0
λ: 310 nm Amax: 0.40
λ: 335 nm Amax: 0.03
λ: 360-400 nm Amax: 0.01

application(s)

food and beverages

SMILES string

N#Cc1ccccc1

InChI

1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H

InChI key

JFDZBHWFFUWGJE-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Recommended products

Discover LiChropur reagents ideal for HPLC or LC-MS analysis

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302 + H312

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Oral

Storage Class Code

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

WGK

WGK 1

Flash Point(F)

158.0 °F - closed cup

Flash Point(C)

70 °C - closed cup

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Kenji Ueura et al.
Organic letters, 7(11), 2229-2231 (2005-05-20)
[reaction: see text]. The Suzuki-Miyaura-type cross-coupling of arylboron compounds with aryl halides proceeds efficiently in the presence of a rhodium-based catalyst system to produce the corresponding biaryls. Furthermore, it has unexpectedly been observed that the treatment with benzonitrile under similar
Microwave spectra of isotopic benzonitriles. Refined molecular structure of benzonitrile.
Casado J, et al.
Journal of Molecular Structure, 8(1-2), 211-224 (1971)
Lanthanide-imido complexes and their reactions with benzonitrile.
Dongmei Cui et al.
Angewandte Chemie (International ed. in English), 44(6), 959-962 (2004-12-22)
A multiphase reaction medium including pressurized carbon dioxide and water for selective hydrogenation of benzonitrile with a Pd/Al2O3 catalyst.
Yoshida H, et al.
Applied Catalysis A: General, 456, 215-222 (2013)
Jessica L Durham et al.
Inorganic chemistry, 51(14), 7825-7836 (2012-07-07)
The preparation of two new families of hexanuclear rhenium cluster complexes containing benzonitrile and phenyl-substituted tetrazolate ligands is described. Specifically, we report the preparation of a series of cluster complexes with the formula [Re(6)Se(8)(PEt(3))(5)L](2+) where L = benzonitrile, p-aminobenzonitrile, p-methoxybenzonitrile
View All Related Papers

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service