Basic information
- CAS
7133-46-2- Standard SMILES
C1CCC(SC2CCCCC2)CC1- InChIKey
FTAORUVBXKFVDA-UHFFFAOYSA-N- Molecular formula
- C12H22S
- Average molar mass
- 198.37 g/mol
- Monoisotopic mass
- 198.1442217
Names & identifiers
- Preferred name
- 1,1'-Thiobis(cyclohexane)
- IUPAC
- cyclohexylsulfanylcyclohexane
- English name
- dicyclohexyl sulphide
- Molecular formula
- C12H22S
- Molecular weight
- 198.36808
Names & synonyms
Dicyclohexyl sulphide7133-46-2DTXSID30221524RefChem:10516331,1'-Thiobis(cyclohexane)DTXCID60144015230-432-7DICYCLOHEXYL SULFIDEDicyclohexylsulphideEINECS 230-432-71,1'-SulfanediyldicyclohexaneCyclohexane, 1,1'-thiobis-
Show more names
1,1'-Thiobiscyclohexanecyclohexylsulfanylcyclohexane
SCHEMBL575824SCHEMBL9507572SCHEMBL28069899(Cyclohexylsulfanyl)cyclohexane #NS00037189
Database identifiers
- CAS
7133-46-2- PubChem CID
- 23523
- DTXSID
DTXSID30221524- EC Number
- 230-432-7
- Nikkaji
- J23.484B
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Melting point
- 9.9 °C · 9.9°C
- Boiling point
- 295.71 °C · 295.71°C (rough estimate)
- Density
- 0.9766 · 0.9766 (rough estimate)
- refractive index
- 1.5142 · 1.5142 (estimate)
Chemistry & industry
Suppliers4 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
Loading…