Basic information
- CAS
50473-81-9- Standard SMILES
Nc1ccccc1Nc1nccs1- InChIKey
GBJLRZLHTJTIGA-UHFFFAOYSA-N- Molecular formula
- C9H9N3S
- Average molar mass
- 191.26 g/mol
- Monoisotopic mass
- 191.05171847
Names & identifiers
- Preferred name
- N~1~-(1,3-Thiazol-2-yl)benzene-1,2-diamine
- IUPAC
- 2-N-(1,3-thiazol-2-yl)benzene-1,2-diamine
Names & synonyms
50473-81-9N~1~-(1,3-Thiazol-2-yl)benzene-1,2-diamineSCHEMBL11159476DTXSID10608177DB-071204
Database identifiers
- CAS
50473-81-9- PubChem CID
- 20501002
- DTXSID
DTXSID10608177
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 79.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…