894-86-0 Purity
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Specification
The molecular formula of the compound is C6H12S.
The molecular weight of the compound is 116.23 g/mol.
The IUPAC name of the compound is (E)-2-methyl-1-methylsulfanylbut-2-ene.
The InChIKey of the compound is PBWZEERIWACABP-GQCTYLIASA-N.
The canonical SMILES of the compound is CC=C(C)CSC.
The CAS number of the compound is 89534-74-7.
The FEMA number of the compound is 4173.
The XLogP3-AA value of the compound is 2.4.
The compound has 0 hydrogen bond donor counts.
The compound has 2 rotatable bond counts.