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Home Halogens Benzene, 1,2,3,4,5-pentachloro-6-(methylthio)-

Benzene, 1,2,3,4,5-pentachloro-6-(methylthio)-

CAS No.:
1825-19-0
Catalog Number:
AG0023Y1
Molecular Formula:
C7H3Cl5S
Molecular Weight:
296.4287
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$153
- +
5g
>98.0%(GC)
1 week
United States
$384
- +
Product Description
Catalog Number:
AG0023Y1
Chemical Name:
Benzene, 1,2,3,4,5-pentachloro-6-(methylthio)-
CAS Number:
1825-19-0
Molecular Formula:
C7H3Cl5S
Molecular Weight:
296.4287
MDL Number:
MFCD00013622
IUPAC Name:
1,2,3,4,5-pentachloro-6-methylsulfanylbenzene
InChI:
InChI=1S/C7H3Cl5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
InChI Key:
LGZZJTIUEJNNKV-UHFFFAOYSA-N
SMILES:
CSc1c(Cl)c(Cl)c(c(c1Cl)Cl)Cl
EC Number:
217-363-8
UNII:
9FRH35YH8R
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.837g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.411g/mol
Monoisotopic Mass:
293.84g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6  
Literature
Title Journal
Comparison of bifunctional chelates for (64)Cu antibody imaging. European journal of nuclear medicine and molecular imaging 20101101
Multiresidue analysis of 18 organochlorine pesticides in traditional chinese medicine. Journal of chromatographic science 20060901
Properties