Basic information
- CAS
929340-89-6- Standard SMILES
Cc1ccc(-c2nnsc2N)cc1- InChIKey
LFFKKLJXLAAOJB-UHFFFAOYSA-N- Molecular formula
- C9H9N3S
- Average molar mass
- 191.26 g/mol
- Monoisotopic mass
- 191.05171847
Names & identifiers
- Preferred name
- 4-(4-Methylphenyl)-1,2,3-thiadiazol-5-amine
- IUPAC
- 4-(4-methylphenyl)thiadiazol-5-amine
Names & synonyms
DTXSID7012636684-(4-Methylphenyl)-1,2,3-thiadiazol-5-amine929340-89-6
Database identifiers
- CAS
929340-89-6- PubChem CID
- 83684875
- DTXSID
DTXSID701263668
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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