Basic information
- Standard SMILES
Sc1nnnn1-c1ccccc1- InChIKey
GGZHVNZHFYCSEV-UHFFFAOYSA-N- Molecular formula
- C7H6N4S
- Average molar mass
- 178.22 g/mol
- Monoisotopic mass
- 178.03131738
Names & identifiers
- IUPAC
- 1-phenyltetrazole-5-thiol
Database identifiers
- PubChem CID
- 66592
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 44.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 148
Related reactions
68 records
Linked notes
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