Basic information
- CAS
2669-97-8- Standard SMILES
S=C1NCN(C2CCCCC2)CN1- InChIKey
NYIFUCGHCMSJJP-UHFFFAOYSA-N- Molecular formula
- C9H17N3S
- Average molar mass
- 199.32 g/mol
- Monoisotopic mass
- 199.11431873
Names & identifiers
- Preferred name
- 5-Cyclohexyl-1,3,5-triazinane-2-thione
- IUPAC
- 5-cyclohexyl-1,3,5-triazinane-2-thione
Names & synonyms
5-cyclohexyl-1,3,5-triazinane-2-thione2669-97-8DTXSID20354496RefChem:302728DTXCID903055561,3,5-Triazine-2(1H)-thione, 5-cyclohexyltetrahydro-ChemDiv3_000289Oprea1_796271SCHEMBL9645898HMS1473N03CCG-15179STL168797
Show more names
AKOS001482336IDI1_019607NCGC00176443-01ST1020125-cyclohexyl-[1,3,5]triazinane-2-thioneST450655385-cyclohexyl-1,3,5-triazaperhydroine-2-thioneAH-034/32862016
Database identifiers
- CAS
2669-97-8- PubChem CID
- 775005
- DTXSID
DTXSID20354496
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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