Home Aminos 2-amino-4lambda5-[1,2,4]thiadiazolo[2,3-a]pyridin-4-ylium chloride

2-amino-4lambda5-[1,2,4]thiadiazolo[2,3-a]pyridin-4-ylium chloride

CAS No.:
36273-97-9
Catalog Number:
AG01BGNH
Molecular Formula:
C6H6ClN3S
Molecular Weight:
187.6499
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Product Description
Catalog Number:
AG01BGNH
Chemical Name:
2-amino-4lambda5-[1,2,4]thiadiazolo[2,3-a]pyridin-4-ylium chloride
CAS Number:
36273-97-9
Molecular Formula:
C6H6ClN3S
Molecular Weight:
187.6499
MDL Number:
MFCD20696214
IUPAC Name:
[1,2,4]thiadiazolo[2,3-a]pyridin-4-ium-2-amine;chloride
InChI:
InChI=1S/C6H5N3S.ClH/c7-6-8-5-3-1-2-4-9(5)10-6;/h1-4,7H;1H
InChI Key:
LUQMWCGRINTRPQ-UHFFFAOYSA-N
SMILES:
Nc1nc2[n+](s1)cccc2.[Cl-]
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.997g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.645g/mol
Monoisotopic Mass:
186.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties