cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane

C6H11S4- — CID 18339963

IUPACcyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane
SMILESS=S(=S)([S-])C1CCCCC1
InChIInChI=1S/C6H12S4/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2,(H,7,8,9)/p-1
InChIKeySTCDKIHLQRLSOD-UHFFFAOYSA-M
MW211.42 g/mol
LogP1.86
Rot. Bonds1

About cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane

cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane (PubChem CID 18339963) has the molecular formula C6H11S4- and a molecular weight of 211.42 g/mol. Its IUPAC name is cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane.

Molecular Properties

Compound Namecyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane
PubChem CID18339963
Molecular FormulaC6H11S4-
Molecular Weight211.42 g/mol
Exact Mass210.97
IUPAC Namecyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane
SMILESS=S(=S)([S-])C1CCCCC1
InChIInChI=1S/C6H12S4/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2,(H,7,8,9)/p-1
InChIKeySTCDKIHLQRLSOD-UHFFFAOYSA-M
XLogP1.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.42
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Related Compounds

Cyclohexanethiol
CID 15290
Cyclohexane-1,2-dithiol
CID 5242646
Cyclohexanesulfenyl chloride
CID 87312
Lithium cyclohexanethiolate
CID 11137158
(Methyldisulfanyl)cyclohexane
CID 13627491
1,4-Dithiocyclohexane
CID 18172212
Potassium cyclohexanethiolate
CID 23688000
Sodium cyclohexanethiolate
CID 23688014
1,6-Hexanedithiol dimercaptan
CID 140355853
1-(Disulfanyl)-4-fluorocyclohexane
CID 87424436
1-(Disulfanyl)-2-fluorocyclohexane
CID 87424806
1-(Disulfanyl)-3-fluorocyclohexane
CID 87424926

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane?
The IUPAC name of cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane (CID 18339963) is cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane.
What is the SMILES notation for cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane?
The canonical SMILES for cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane is S=S(=S)([S-])C1CCCCC1.
What is the InChIKey of cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane?
The InChIKey is STCDKIHLQRLSOD-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H12S4/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2,(H,7,8,9)/p-1.
What are the key properties of cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane?
cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane has a molecular weight of 211.42 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-bis(sulfanylidene)-sulfido-λ6-sulfane is sourced from PubChem (CID 18339963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).