94246-72-7 Purity
96%
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The molecular formula of Di-tert-hexyl sulphide is C12H26S.
Di-tert-hexyl sulphide was created on PubChem on August 20, 2009.
The IUPAC name of Di-tert-hexyl sulphide is 2-methyl-2-(2-methylpentan-2-ylsulfanyl)pentane.
The InChIKey of Di-tert-hexyl sulphide is IEEFWTULOQFBBV-UHFFFAOYSA-N.
The canonical SMILES of Di-tert-hexyl sulphide is CCCC(C)(C)SC(C)(C)CCC.
The molecular weight of Di-tert-hexyl sulphide is 202.40 g/mol.
Di-tert-hexyl sulphide has 0 hydrogen bond donor count.
Di-tert-hexyl sulphide has 6 rotatable bond counts.
The topological polar surface area of Di-tert-hexyl sulphide is 25.3 Ų.
Yes, the compound Di-tert-hexyl sulphide is canonicalized in PubChem.