sales@angenesci.com
Login | Register
logo
Structures Search
Home Sulfos 2-Methyl-5-(methylsulfonyl)pyrimidin-4(3h)-one

2-Methyl-5-(methylsulfonyl)pyrimidin-4(3h)-one

CAS No.:
17551-48-3
Catalog Number:
AG00HZOE
Molecular Formula:
C6H8N2O3S
Molecular Weight:
188.2043
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG00HZOE
Chemical Name:
2-Methyl-5-(methylsulfonyl)pyrimidin-4(3h)-one
CAS Number:
17551-48-3
Molecular Formula:
C6H8N2O3S
Molecular Weight:
188.2043
MDL Number:
MFCD00085715
IUPAC Name:
2-methyl-5-methylsulfonyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C6H8N2O3S/c1-4-7-3-5(6(9)8-4)12(2,10)11/h3H,1-2H3,(H,7,8,9)
InChI Key:
LOEFVJGHANFJTC-UHFFFAOYSA-N
SMILES:
Cc1ncc(c(=O)[nH]1)S(=O)(=O)C
Properties
Complexity:
372  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.026g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.201g/mol
Monoisotopic Mass:
188.026g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties