methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane

C6H16S4 — CID 159829383

IUPACmethyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane
SMILESC=S(=C)(C)SC.CSSC
InChIInChI=1S/C4H10S2.C2H6S2/c1-5-6(2,3)4;1-3-4-2/h2-3H2,1,4H3;1-2H3
InChIKeyNNGMGOQDKWMUBI-UHFFFAOYSA-N
MW216.46 g/mol
LogP3.19
Rot. Bonds2

About methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane

methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane (PubChem CID 159829383) has the molecular formula C6H16S4 and a molecular weight of 216.46 g/mol. Its IUPAC name is methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane.

Molecular Properties

Compound Namemethyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane
PubChem CID159829383
Molecular FormulaC6H16S4
Molecular Weight216.46 g/mol
Exact Mass216.01
IUPAC Namemethyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane
SMILESC=S(=C)(C)SC.CSSC
InChIInChI=1S/C4H10S2.C2H6S2/c1-5-6(2,3)4;1-3-4-2/h2-3H2,1,4H3;1-2H3
InChIKeyNNGMGOQDKWMUBI-UHFFFAOYSA-N
XLogP3.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.46
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(methyldisulfanyl)methane;nickel
CID 159414601
dimethyl-methylidyne-methylsulfanyl-λ6-sulfane
CID 118494460
sodium;hydride;(methyldisulfanyl)methane
CID 173290798
(methyldisulfanyl)methane;molecular hydrogen
CID 174883905
(methyldisulfanyl)methane;sulfuric acid
CID 172837638
disulfanylmethane;(methyldisulfanyl)methane
CID 91453879
chloro-methyl-dimethylidene-λ6-sulfane
CID 88551469
methanedithione;(methyldisulfanyl)methane
CID 174936185
CID 140654775
CID 140654775
(ethyldisulfanyl)ethane;(methyldisulfanyl)methane
CID 87339090
hexane;tris((methyldisulfanyl)methane)
CID 162088093
methanesulfonic acid;methylsulfanylmethane
CID 174896398

Frequently Asked Questions

What is the IUPAC name of methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane?
The IUPAC name of methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane (CID 159829383) is methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane.
What is the SMILES notation for methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane?
The canonical SMILES for methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane is C=S(=C)(C)SC.CSSC.
What is the InChIKey of methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane?
The InChIKey is NNGMGOQDKWMUBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10S2.C2H6S2/c1-5-6(2,3)4;1-3-4-2/h2-3H2,1,4H3;1-2H3.
What are the key properties of methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane?
methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane has a molecular weight of 216.46 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-dimethylidene-methylsulfanyl-λ6-sulfane;(methyldisulfanyl)methane is sourced from PubChem (CID 159829383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).