B8959
Benzonitrile
ReagentPlus®, 99%
동의어(들):
Phenyl cyanide
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제품정보 (DICE 배송 시 비용 별도)
Linear Formula:
C6H5CN
CAS 번호:
Molecular Weight:
103.12
NACRES:
NA.21
PubChem Substance ID:
eCl@ss:
39031505
UNSPSC Code:
12352117
EC Number:
202-855-7
MDL number:
Beilstein/REAXYS Number:
506893
Assay:
99%
Bp:
191 °C (lit.)
Quality Level
product line
ReagentPlus®
assay
99%
form
liquid
expl. lim.
0.34-6.3 %
dilution
(for general lab use)
refractive index
n20/D 1.528 (lit.)
bp
191 °C (lit.)
mp
−13 °C (lit.)
SMILES string
N#Cc1ccccc1
InChI
1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H
InChI key
JFDZBHWFFUWGJE-UHFFFAOYSA-N
General description
Benzonitrile, also known as a phenyl cyanide compound, is a useful solvent and a versatile precursor to many derivatives. It is a good solvent for the study of inorganic, organic, anhydrous, and organometallic compounds.
Application
Benzonitrile can be used as:
- An electrochemical solvent to investigate the electrochemistry, spectroscopic properties, and reactivity of a series of cobalt porphyrins with various substituents.
- Building block or starting material in various organic synthesis reactions.
- Employed in coupling reactions, such as Suzuki couplings or Heck reactions, to facilitate the formation of carbon-carbon bonds.
Legal Information
ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Oral
저장 등급
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
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
Rocío López-Rodríguez et al.
The Journal of organic chemistry, 77(21), 9915-9920 (2012-10-18)
A mild procedure for the Ir(III)-catalyzed nitrogen-directed ortho borylation of aromatic N,N-dialkylhydrazones using pinacolborane as the boron source has been developed. The methodology relies on a modified, hemilabile N,N ligand built on a 4-N,N-dimethylaminopyridine unit that provides high reactivity while
Mohsen Sajadi et al.
Physical chemistry chemical physics : PCCP, 13(39), 17768-17774 (2011-09-03)
Time-dependent Stokes shifts (TDSS) were measured for diverse polarity probes in water, heavy water, methanol, and benzonitrile, by broadband fluorescence up-conversion with 85 fs time resolution. In water the spectral dynamics is solute-independent and quantitatively described by simple dielectric continuum