2H-Thiopyranium, tetrahydro-1-methyl-
Basic information
- CAS
41158-37-6- Standard SMILES
C[S+]1CCCCC1- InChIKey
SVIPHUGQXFJZGO-UHFFFAOYSA-N- Molecular formula
- C6H13S+
- Average molar mass
- 117.23 g/mol
- Monoisotopic mass
- 117.07379659
Names & identifiers
- Preferred name
- 2H-Thiopyranium, tetrahydro-1-methyl-
- IUPAC
- 1-methylthian-1-ium
Names & synonyms
2H-Thiopyranium, tetrahydro-1-methyl-41158-37-6DTXSID10329158RefChem:269302DTXCID602802601-methylthian-1-iumSCHEMBL2958757
Database identifiers
- CAS
41158-37-6- PubChem CID
- 417894
- DTXSID
DTXSID10329158- Nikkaji
- J365.933J
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 1
- Complexity
- 46.1
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Compound notes
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