Basic information
- CAS
4637-04-1- Standard SMILES
Nc1nc(=NNc2ccccc2)ss1- InChIKey
FBRBHPIPSCDGAS-UHFFFAOYSA-N- Molecular formula
- C8H8N4S2
- Average molar mass
- 224.3 g/mol
- Monoisotopic mass
- 224.01903862
Names & identifiers
- Preferred name
- 5-(Phenylhydrazinylidene)-1,2,4-dithiazol-3-amine
- IUPAC
- 5-(phenylhydrazinylidene)-1,2,4-dithiazol-3-amine
Names & synonyms
4637-04-15-(phenylhydrazinylidene)-1,2,4-dithiazol-3-amineDTXSID203504333-(2-Phenylhydrazinylidene)-3H-1,2,4-dithiazol-5-amine
Database identifiers
- CAS
4637-04-1- PubChem CID
- 679154
- DTXSID
DTXSID20350433
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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