(2,4,4-trimethyl-2-oxidanyl-pentoxy)methanedithioic acid

Systemtic Name: (2,4,4-trimethyl-2-oxidanyl-pentoxy)methanedithioic acid Openeye Name: (2-hydroxy-2,4,4-trimethyl-pentoxy)methanedithioic acid CAS Name: (2-hydroxy-2,4,4-trimethylpentoxy)methanedithioic acid IUPAC Name: (2-hydroxy-2,4,4-trimethylpentoxy)methanedithioic acid Traditional Name: (2-hydroxy-2,4,4-trimethyl-pentoxy)methanedithioic acid Formula: C9H18O2S2 MolecularWeight: 222.36802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(COC(=S)S)O

Isomeric SMILES

CC(C)(C)CC(C)(COC(=S)S)O

InChI

InChI=1S/C9H18O2S2/c1-8(2,3)5-9(4,10)6-11-7(12)13/h10H,5-6H2,1-4H3,(H,12,13)