Home Aminos 2-((4,6-Diaminopyrimidin-2-yl)thio)acetic acid

2-((4,6-Diaminopyrimidin-2-yl)thio)acetic acid

CAS No.:
6638-40-0
Catalog Number:
AG00FARC
Molecular Formula:
C6H8N4O2S
Molecular Weight:
200.2183
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00FARC
Chemical Name:
2-((4,6-Diaminopyrimidin-2-yl)thio)acetic acid
CAS Number:
6638-40-0
Molecular Formula:
C6H8N4O2S
Molecular Weight:
200.2183
MDL Number:
MFCD02228572
IUPAC Name:
2-(4,6-diaminopyrimidin-2-yl)sulfanylacetic acid
InChI:
InChI=1S/C6H8N4O2S/c7-3-1-4(8)10-6(9-3)13-2-5(11)12/h1H,2H2,(H,11,12)(H4,7,8,9,10)
InChI Key:
JKAISOKGXPAILZ-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1nc(N)cc(n1)N
NSC Number:
48076
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.037g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
200.216g/mol
Monoisotopic Mass:
200.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties