Basic information
- CAS
65192-32-7- Standard SMILES
Cn1ccc[n+](C)c1=S.[O-][Cl+3]([O-])([O-])[O-]- InChIKey
KHZKMQIZRPNHPG-UHFFFAOYSA-M- Molecular formula
- C6H9ClN2O4S
- Average molar mass
- 240.67 g/mol
- Monoisotopic mass
- 239.9971556
Names & identifiers
- Preferred name
- 1,3-Dimethyl-2-sulfanylidene-2,3-dihydropyrimidin-1-ium perchlorate
- IUPAC
- 1,3-dimethylpyrimidin-1-ium-2-thione perchlorate
Names & synonyms
65192-32-7DTXSID304948721,3-Dimethyl-2-sulfanylidene-2,3-dihydropyrimidin-1-ium perchlorate
Database identifiers
- CAS
65192-32-7- PubChem CID
- 12371733
- DTXSID
DTXSID30494872
Properties
Computed structural properties
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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