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69797-51-9

69797-51-9 | 1,1'-Biphenyl,2,3',4',5-tetrachloro-4-(methylsulfonyl)-

CAS No: 69797-51-9 Catalog No: AG005HOJ MDL No:

Product Description

Catalog Number:
AG005HOJ
Chemical Name:
1,1'-Biphenyl,2,3',4',5-tetrachloro-4-(methylsulfonyl)-
CAS Number:
69797-51-9
Molecular Formula:
C13H8Cl4O2S
Molecular Weight:
370.0784
IUPAC Name:
1,4-dichloro-2-(3,4-dichlorophenyl)-5-methylsulfonylbenzene
InChI:
InChI=1S/C13H8Cl4O2S/c1-20(18,19)13-6-10(15)8(5-12(13)17)7-2-3-9(14)11(16)4-7/h2-6H,1H3
InChI Key:
JQUKTDLZMGSALF-UHFFFAOYSA-N
SMILES:
Clc1cc(c(cc1c1ccc(c(c1)Cl)Cl)Cl)S(=O)(=O)C

Properties

Complexity:
436  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.897g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.065g/mol
Monoisotopic Mass:
367.9g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  

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