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About This Item
Empirical Formula (Hill Notation):
C6H5Cl
CAS Number:
Molecular Weight:
112.56
Beilstein:
605632
EC Number:
MDL number:
UNSPSC Code:
12352101
PubChem Substance ID:
NACRES:
NA.21
Recommended Products
grade
anhydrous
Quality Level
vapor density
3.86 (vs air)
vapor pressure
11.8 mmHg ( 25 °C)
Assay
99.8%
form
liquid
autoignition temp.
1178 °F
expl. lim.
7.1 %
impurities
<0.005% water
evapn. residue
<0.0005%
refractive index
n20/D 1.524 (lit.)
bp
132 °C (lit.)
mp
−45 °C (lit.)
density
1.106 g/mL at 25 °C (lit.)
SMILES string
Clc1ccccc1
InChI
1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H
InChI key
MVPPADPHJFYWMZ-UHFFFAOYSA-N
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Application
Chlorobenzene may be used in the arylation of 2-isobutylthiazole in the presence of palladium (II) acetate-butyldi-1-adamantylphosphine to form 5-phenyl-2-isobutylthiazole. It may also be used as a solvent for the synthesis of rhodium II tetrakis(triphenylacetate) dimer, an efficient rhodium catalyst for nitrene C-H insertion reactions.
Other Notes
The article number 284513-6X1L will be discontinued. Please order the single bottle 284513-1L which is physically identical with the same exact specifications.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Inhalation - Aquatic Chronic 2 - Flam. Liq. 3 - Skin Irrit. 2
Storage Class Code
3 - Flammable liquids
WGK
WGK 2
Flash Point(F)
80.6 °F
Flash Point(C)
27 °C
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Palladium (II) acetate-butyldi-1-adamantylphosphine catalyzed arylation of electron-rich heterocycles. preparation of 5-phenyl-2-isobutylthiazole.
Organic Syntheses, 89, 105-105 (2009)
K. Huard and H. Lebel,
Organic Syntheses, 86, 59-69 (2009)
Preparation of 4-spirocyclohexyloxazolidinone by C-H bond nitrene insertion
Huard K and Lebel H
Organic Syntheses, 86, 59-59 (2009)
Efficient recyclable organic solar cells on cellulose nanocrystal substrates with a conducting polymer top electrode deposited by film-transfer lamination.
Zhou Y, et al.
Organic Electronics, 15(3), 661-666 (2014)
Eagleson M.
Concise Encyclopedia Chemistry, 302-302 (1994)
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