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Home Halogens 1-chloro-4-(1-chloroethyl)benzene

1-chloro-4-(1-chloroethyl)benzene

CAS No.:
20001-65-4
Catalog Number:
AG019YB2
Molecular Formula:
C8H8Cl2
Molecular Weight:
175.0551
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Product Description
Catalog Number:
AG019YB2
Chemical Name:
1-chloro-4-(1-chloroethyl)benzene
CAS Number:
20001-65-4
Molecular Formula:
C8H8Cl2
Molecular Weight:
175.0551
MDL Number:
MFCD10691619
IUPAC Name:
1-chloro-4-(1-chloroethyl)benzene
InChI:
InChI=1S/C8H8Cl2/c1-6(9)7-2-4-8(10)5-3-7/h2-6H,1H3
InChI Key:
NOCHRVHWICTPLG-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(Cl)C
Properties
Complexity:
95.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.052g/mol
Monoisotopic Mass:
174g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
3-[1-(4-Chloro-phen-yl)eth-yl]-1,3-thia-zinane-2-thione. Acta crystallographica. Section E, Structure reports online 20110201
(E)-1-[1-(4-Chloro-phen-yl)eth-yl]-3,5-dimethyl-N-nitro-1,3,5-triazinan-2-imine. Acta crystallographica. Section E, Structure reports online 20101201
(Z)-N-{3-[1-(4-Chloro-phen-yl)eth-yl]thia-zolidin-2-yl-idene}cyanamide. Acta crystallographica. Section E, Structure reports online 20100801
Properties