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(1-Chloroethyl)benzene

CAS No.:
672-65-1
Catalog Number:
AG003E74
Molecular Formula:
C8H9Cl
Molecular Weight:
140.6101
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Product Description
Catalog Number:
AG003E74
Chemical Name:
(1-Chloroethyl)benzene
CAS Number:
672-65-1
Molecular Formula:
C8H9Cl
Molecular Weight:
140.6101
MDL Number:
MFCD00018870
IUPAC Name:
1-chloroethylbenzene
InChI:
InChI=1S/C8H9Cl/c1-7(9)8-5-3-2-4-6-8/h2-7H,1H3
InChI Key:
GTLWADFFABIGAE-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)Cl
EC Number:
211-594-8
Properties
Complexity:
74.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.039g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.61g/mol
Monoisotopic Mass:
140.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Electrochemical carboxylation of alpha-chloroethylbenzene in ionic liquids compressed with carbon dioxide. Physical chemistry chemical physics : PCCP 20100227
Antiproliferative and pro-apoptotic effects afforded by novel Src-kinase inhibitors in human neuroblastoma cells. BMC cancer 20100101
3-(1-Phenyl-ethyl)-1,3-thia-zinane-2-thione. Acta crystallographica. Section E, Structure reports online 20091201
Palladium(II) complexes of new bulky bidentate phosphanes: active and highly regioselective catalysts for the hydroxycarbonylation of styrene. Chemistry (Weinheim an der Bergstrasse, Germany) 20091012
Electrocarboxylation of benzyl halides through redox catalysis on the preparative scale. Chemistry (Weinheim an der Bergstrasse, Germany) 20060925
The individual and cumulative effect of brominated flame retardant and polyvinylchloride (PVC) on thermal degradation of acrylonitrile-butadiene-styrene (ABS) copolymer. Chemosphere 20040801
Synthesis of 1-(2-chloro-2-phenylethyl)-6-methylthio-1H-pyrazolo[3,4-d]pyrimidines 4-amino substituted and their biological evaluation. European journal of medicinal chemistry 20040201
Hydrogen peroxide oxidation of mustard-model sulfides catalyzed by iron and manganese tetraarylporphyrines. Oxygen transfer to sulfides versus H(2)O(2) dismutation and catalyst breakdown. The Journal of organic chemistry 20011116
Properties