Home Sulfos Phenyl 4-bromobenzenesulfonate

Phenyl 4-bromobenzenesulfonate

CAS No.:
5455-14-1
Catalog Number:
AG003TOT
Molecular Formula:
C12H9BrO3S
Molecular Weight:
313.1671
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$105
- +
5g
98%
In Stock USA
United States
$315
- +
Product Description
Catalog Number:
AG003TOT
Chemical Name:
Phenyl 4-bromobenzenesulfonate
CAS Number:
5455-14-1
Molecular Formula:
C12H9BrO3S
Molecular Weight:
313.1671
MDL Number:
MFCD09475912
IUPAC Name:
phenyl 4-bromobenzenesulfonate
InChI:
InChI=1S/C12H9BrO3S/c13-10-6-8-12(9-7-10)17(14,15)16-11-4-2-1-3-5-11/h1-9H
InChI Key:
ARYXAYIIDXKEDB-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)S(=O)(=O)Oc1ccccc1
NSC Number:
23317
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.946g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.165g/mol
Monoisotopic Mass:
311.946g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties