Home Sulfos Methylsulfonylacetone

Methylsulfonylacetone

CAS No.:
5000-46-4
Catalog Number:
AG003D3N
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$53
- +
5g
98%
1 week
United States
$84
- +
25g
98%
1 week
United States
$224
- +
100g
98%
1 week
United States
$725
- +
500g
98%
1 week
United States
$2809
- +
Product Description
Catalog Number:
AG003D3N
Chemical Name:
Methylsulfonylacetone
CAS Number:
5000-46-4
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
MDL Number:
MFCD00014745
IUPAC Name:
1-methylsulfonylpropan-2-one
InChI:
InChI=1S/C4H8O3S/c1-4(5)3-8(2,6)7/h3H2,1-2H3
InChI Key:
NWEYGXQKFVGUFR-UHFFFAOYSA-N
SMILES:
CC(=O)CS(=O)(=O)C
EC Number:
225-665-6
NSC Number:
35395
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.019g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.165g/mol
Monoisotopic Mass:
136.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties