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Home Other Building Blocks 4-Hydroxy-2-(methylthio)-6-(trifluoromethyl)pyrimidine

4-Hydroxy-2-(methylthio)-6-(trifluoromethyl)pyrimidine

CAS No.:
16097-62-4
Catalog Number:
AG001VJO
Molecular Formula:
C6H5F3N2OS
Molecular Weight:
210.1769
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$24
- +
5g
98%
In Stock USA
United States
$70
- +
10g
98%
In Stock USA
United States
$122
- +
25g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG001VJO
Chemical Name:
4-Hydroxy-2-(methylthio)-6-(trifluoromethyl)pyrimidine
CAS Number:
16097-62-4
Molecular Formula:
C6H5F3N2OS
Molecular Weight:
210.1769
MDL Number:
MFCD00674594
IUPAC Name:
2-methylsulfanyl-4-(trifluoromethyl)-1H-pyrimidin-6-one
InChI:
InChI=1S/C6H5F3N2OS/c1-13-5-10-3(6(7,8)9)2-4(12)11-5/h2H,1H3,(H,10,11,12)
InChI Key:
BRLPDRZKOMZVOY-UHFFFAOYSA-N
SMILES:
CSc1nc(cc(=O)[nH]1)C(F)(F)F
NSC Number:
64343
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.007g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.174g/mol
Monoisotopic Mass:
210.007g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties