2,2-bis(hydroxymethyl)propane-1,3-diol; butane-1,3-dithiol

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butane-1,3-dithiol Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butane-1,3-dithiol CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butane-1,3-dithiol IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; butane-1,3-dithiol Traditional Name: butane-1,3-dithiol; 2,2-dimethylolpropane-1,3-diol Formula: C17H42O4S6 MolecularWeight: 502.90298

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCS)S.CC(CCS)S.CC(CCS)S.C(C(CO)(CO)CO)O

Isomeric SMILES

CC(CCS)S.CC(CCS)S.CC(CCS)S.C(C(CO)(CO)CO)O

InChI

InChI=1S/C5H12O4.3C4H10S2/c6-1-5(2-7,3-8)4-9;3*1-4(6)2-3-5/h6-9H,1-4H2;3*4-6H,2-3H2,1H3