pentamethyl(methylsulfanyl)-λ6-sulfane

C6H18S2 — CID 151901633

IUPACpentamethyl(methylsulfanyl)-λ6-sulfane
SMILESCSS(C)(C)(C)(C)C
InChIInChI=1S/C6H18S2/c1-7-8(2,3,4,5)6/h1-6H3
InChIKeySSWPUHUQUBKABU-UHFFFAOYSA-N
MW154.34 g/mol
LogP2.29
Rot. Bonds1

About pentamethyl(methylsulfanyl)-λ6-sulfane

pentamethyl(methylsulfanyl)-λ6-sulfane (PubChem CID 151901633) has the molecular formula C6H18S2 and a molecular weight of 154.34 g/mol. Its IUPAC name is pentamethyl(methylsulfanyl)-λ6-sulfane.

Molecular Properties

Compound Namepentamethyl(methylsulfanyl)-λ6-sulfane
PubChem CID151901633
Molecular FormulaC6H18S2
Molecular Weight154.34 g/mol
Exact Mass154.08
IUPAC Namepentamethyl(methylsulfanyl)-λ6-sulfane
SMILESCSS(C)(C)(C)(C)C
InChIInChI=1S/C6H18S2/c1-7-8(2,3,4,5)6/h1-6H3
InChIKeySSWPUHUQUBKABU-UHFFFAOYSA-N
XLogP2.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.34
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of pentamethyl(methylsulfanyl)-λ6-sulfane?
The IUPAC name of pentamethyl(methylsulfanyl)-λ6-sulfane (CID 151901633) is pentamethyl(methylsulfanyl)-λ6-sulfane.
What is the SMILES notation for pentamethyl(methylsulfanyl)-λ6-sulfane?
The canonical SMILES for pentamethyl(methylsulfanyl)-λ6-sulfane is CSS(C)(C)(C)(C)C.
What is the InChIKey of pentamethyl(methylsulfanyl)-λ6-sulfane?
The InChIKey is SSWPUHUQUBKABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18S2/c1-7-8(2,3,4,5)6/h1-6H3.
What are the key properties of pentamethyl(methylsulfanyl)-λ6-sulfane?
pentamethyl(methylsulfanyl)-λ6-sulfane has a molecular weight of 154.34 g/mol, XLogP of 2.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentamethyl(methylsulfanyl)-λ6-sulfane is sourced from PubChem (CID 151901633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).