chempirical

6-Aminopyridine-3-sulfonic acid

C5H6N2O3SCAS 16250-08-1174.17 g/mol

Open in Covalent MOL file
NSOOHONH2
Primary amineSulfonic acid

Properties

Molecular formula
C5H6N2O3S
Molar mass
174.17 g/mol
Exact mass
174.0099 Da
logP
-0.09Crippen estimate
Polar surface area
93.3 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
1

Identifiers

CAS number
16250-08-1
SMILES
C1=CC(=NC=C1S(=O)(=O)O)N
InChIKey
YXFLGKSXYWHALA-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2O3S/c6-5-2-1-4(3-7-5)11(8,9)10/h1-3H,(H2,6,7)(H,8,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names
  • 2-Aminopyridine-5-sulfonic acid

Work with 6-Aminopyridine-3-sulfonic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sulfanilic acid121-57-352 % similar 3-Pyridinesulfonic acid636-73-747 % similar 3,4-Diaminobenzenesulfonic acid7474-78-447 % similar [1,1′-Biphenyl]-4,4′-disulfonic acid5314-37-447 % similar Aniline-2,4-disulfonic acid137-51-944 % similar 2-Amino-1,4-benzenedisulfonic acid98-44-244 % similar 4-Hydrazinobenzenesulfonic acid98-71-544 % similar 2,6-Naphthalenedisulfonic acid581-75-944 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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