Basic information
- CAS
62009-35-2- Standard SMILES
Nc1cncc(S(=O)(=O)O)c1- InChIKey
ALOOMEVLNVJJSZ-UHFFFAOYSA-N- Molecular formula
- C5H6N2O3S
- Average molar mass
- 174.18 g/mol
- Monoisotopic mass
- 174.00991323
Names & identifiers
- Preferred name
- 5-Aminopyridine-3-sulfonic acid
- IUPAC
- 5-aminopyridine-3-sulfonic acid
- English name
- 5-Aminopyridine-3-sulfonate
- Molecular formula
- C5H6N2O3S
- Molecular weight
- 174.18
Names & synonyms
5-Aminopyridine-3-sulfonic acid62009-35-25-Aminopyridine-3-sulfonate3-Pyridinesulfonic acid, 5-amino-SCHEMBL11638312DTXSID90506804MFCD08751322AKOS006288333SY466310TS-00169DB-081922ALOOMEVLNVJJSZ-UHFFFAOYSA-N
Database identifiers
- CAS
62009-35-2- PubChem CID
- 12684262
- DTXSID
DTXSID90506804
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 220
Physicochemical properties
- Melting point
- 300 °C · >300 °C(Solv: ethanol (64-17-5))
- Density
- 1.617 · 1.617±0.06 g/cm3(Predicted)
- pka
- -2.04 · -2.04±0.36(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
韶远科技（上海）有限公司4000665055 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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