Home Sulfos 2-Bromophenyl p-toluenesulfonate

2-Bromophenyl p-toluenesulfonate

CAS No.:
84672-48-0
Catalog Number:
AG008GZR
Molecular Formula:
C13H11BrO3S
Molecular Weight:
327.1936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$128
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Product Description
Catalog Number:
AG008GZR
Chemical Name:
2-Bromophenyl p-toluenesulfonate
CAS Number:
84672-48-0
Molecular Formula:
C13H11BrO3S
Molecular Weight:
327.1936
MDL Number:
MFCD19707445
IUPAC Name:
(2-bromophenyl) 4-methylbenzenesulfonate
InChI:
InChI=1S/C13H11BrO3S/c1-10-6-8-11(9-7-10)18(15,16)17-13-5-3-2-4-12(13)14/h2-9H,1H3
InChI Key:
ZXJVRRGBOXUFSQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1Br
NSC Number:
95721
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.961g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.192g/mol
Monoisotopic Mass:
325.961g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties