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112581-51-8 | Imidazo[1,2-a]pyridine-3-sulfonic acid
CAS No: 112581-51-8 Catalog No: AG007SX9 MDL No:MFCD13176742
Product Description
Catalog Number:
AG007SX9
Chemical Name:
Imidazo[1,2-a]pyridine-3-sulfonic acid
CAS Number:
112581-51-8
Molecular Formula:
C7H6N2O3S
Molecular Weight:
198.1991
MDL Number:
MFCD13176742
IUPAC Name:
imidazo[1,2-a]pyridine-3-sulfonic acid
InChI:
InChI=1S/C7H6N2O3S/c10-13(11,12)7-5-8-6-3-1-2-4-9(6)7/h1-5H,(H,10,11,12)
InChI Key:
JLAKLCCPOHSRQJ-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1cnc2n1cccc2
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.01g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.196g/mol
Monoisotopic Mass:
198.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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