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Home Sulfos 4-(4-Methylsulfonylphenyl)benzoic acid

4-(4-Methylsulfonylphenyl)benzoic acid

CAS No.:
16734-98-8
Catalog Number:
AG001XBE
Molecular Formula:
C14H12O4S
Molecular Weight:
276.3077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$50
- +
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG001XBE
Chemical Name:
4-(4-Methylsulfonylphenyl)benzoic acid
CAS Number:
16734-98-8
Molecular Formula:
C14H12O4S
Molecular Weight:
276.3077
MDL Number:
MFCD06802567
IUPAC Name:
4-(4-methylsulfonylphenyl)benzoic acid
InChI:
InChI=1S/C14H12O4S/c1-19(17,18)13-8-6-11(7-9-13)10-2-4-12(5-3-10)14(15)16/h2-9H,1H3,(H,15,16)
InChI Key:
QSBUYGJDNKPSAR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
407  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.046g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.306g/mol
Monoisotopic Mass:
276.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties