Home Sulfos Methyl 4-(methanesulfonylmethyl)benzoate

Methyl 4-(methanesulfonylmethyl)benzoate

CAS No.:
160446-22-0
Catalog Number:
AG001RXD
Molecular Formula:
C10H12O4S
Molecular Weight:
228.2649
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$200
- +
Product Description
Catalog Number:
AG001RXD
Chemical Name:
Methyl 4-(methanesulfonylmethyl)benzoate
CAS Number:
160446-22-0
Molecular Formula:
C10H12O4S
Molecular Weight:
228.2649
MDL Number:
MFCD00051693
IUPAC Name:
methyl 4-(methylsulfonylmethyl)benzoate
InChI:
InChI=1S/C10H12O4S/c1-14-10(11)9-5-3-8(4-6-9)7-15(2,12)13/h3-6H,7H2,1-2H3
InChI Key:
XCKJFFWCTKJUKD-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)CS(=O)(=O)C
EC Number:
918-600-4
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.262g/mol
Monoisotopic Mass:
228.046g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties