3H-1,2,4-Dithiazol-5-amine, N,N-bis(1-methylethyl)-3-(methylimino)-
Basic information
- CAS
58106-13-1- Standard SMILES
CN=c1nc(N(C(C)C)C(C)C)ss1- InChIKey
XWFOXIGPORTBRO-UHFFFAOYSA-N- Molecular formula
- C9H17N3S2
- Average molar mass
- 231.4 g/mol
- Monoisotopic mass
- 231.0863899
Names & identifiers
- Preferred name
- 3H-1,2,4-Dithiazol-5-amine, N,N-bis(1-methylethyl)-3-(methylimino)-
- IUPAC
- 5-methylimino-N,N-di(propan-2-yl)-1,2,4-dithiazol-3-amine
Names & synonyms
58106-13-13H-1,2,4-Dithiazol-5-amine, N,N-bis(1-methylethyl)-3-(methylimino)-DTXSID70481589(3Z)-3-(Methylimino)-N,N-di(propan-2-yl)-3H-1,2,4-dithiazol-5-amine
Database identifiers
- CAS
58106-13-1- PubChem CID
- 12232247
- DTXSID
DTXSID70481589
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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