Home Carboxys 5-Amino-2-(methylthio)pyrimidine-4-carboxylic acid

5-Amino-2-(methylthio)pyrimidine-4-carboxylic acid

CAS No.:
100130-05-0
Catalog Number:
AG00011I
Molecular Formula:
C6H7N3O2S
Molecular Weight:
185.2037
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$73
- +
5g
97%
In Stock USA
United States
$294
- +
10g
97%
In Stock USA
United States
$525
- +
25g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00011I
Chemical Name:
5-Amino-2-(methylthio)pyrimidine-4-carboxylic acid
CAS Number:
100130-05-0
Molecular Formula:
C6H7N3O2S
Molecular Weight:
185.2037
MDL Number:
MFCD12407810
IUPAC Name:
5-amino-2-methylsulfanylpyrimidine-4-carboxylic acid
InChI:
InChI=1S/C6H7N3O2S/c1-12-6-8-2-3(7)4(9-6)5(10)11/h2H,7H2,1H3,(H,10,11)
InChI Key:
NTEPDMJNOBYJHJ-UHFFFAOYSA-N
SMILES:
CSc1ncc(c(n1)C(=O)O)N
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.026g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
185.201g/mol
Monoisotopic Mass:
185.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties