5-Methyl[1,5]thiazocane
Basic information
- CAS
5932-57-0- Standard SMILES
CN1CCCSCCC1- InChIKey
SFNHCMMZTDBFFL-UHFFFAOYSA-N- Molecular formula
- C7H15NS
- Average molar mass
- 145.27 g/mol
- Monoisotopic mass
- 145.09252066
Names & identifiers
- Preferred name
- 5-Methyl[1,5]thiazocane
- IUPAC
- 5-methyl-1,5-thiazocane
Names & synonyms
5-methyl-1,5-thiazocane5-Methyl[1,5]thiazocane5932-57-02H-1,5-Thiazocine, hexahydro-5-methyl-SCHEMBL13189559DTXSID80339981SFNHCMMZTDBFFL-UHFFFAOYSA-N5-methyl-1-thia-5-aza-cyclo-octane
Database identifiers
- CAS
5932-57-0- PubChem CID
- 560574
- DTXSID
DTXSID80339981
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 67.3
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Compound notes
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