Home Other Building Blocks 4-Hydroxy-6-methoxymethylpyrimidine-2-thiol

4-Hydroxy-6-methoxymethylpyrimidine-2-thiol

CAS No.:
175205-07-9
Catalog Number:
AG0020NG
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%
In Stock USA
United States
$150
- +
10g
95%
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG0020NG
Chemical Name:
4-Hydroxy-6-methoxymethylpyrimidine-2-thiol
CAS Number:
175205-07-9
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
MDL Number:
MFCD00052620
IUPAC Name:
6-(methoxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one
InChI:
InChI=1S/C6H8N2O2S/c1-10-3-4-2-5(9)8-6(11)7-4/h2H,3H2,1H3,(H2,7,8,9,11)
InChI Key:
YNVMVIUSRGXSEN-UHFFFAOYSA-N
SMILES:
COCc1cc(=O)[nH]c(=S)[nH]1
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.202g/mol
Monoisotopic Mass:
172.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties