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1391054-81-1,MFCD29045500
Catalog No.:AA01CBP3
1391054-81-1 | 2-(4-Amino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid Potassium Salt
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Technical Information
Catalog Number:
AA01CBP3
Chemical Name:
2-(4-Amino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid Potassium Salt
CAS Number:
1391054-81-1
MDL Number:
MFCD29045500
IUPAC Name:
2-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]ethanesulfonic acid
InChI:
InChI=1S/C5H8N4O3S2/c6-4-7-3-8-5(9-4)13-1-2-14(10,11)12/h3H,1-2H2,(H,10,11,12)(H2,6,7,8,9)
InChI Key:
ICGPQDWXRMFMCX-UHFFFAOYSA-N
Properties
Computed Properties
 
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.004g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.264g/mol
Monoisotopic Mass:
236.004g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
153A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  

Synonyms
 
2-(4-Amino-1,3,5-triazin-2-yl)sulfanylethanesulfonic Acid Potassium Salt 
ZINC77271468 
1391054-81-1 
ICGPQDWXRMFMCX-UHFFFAOYSA-N 
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