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

Systemtic Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; hexane-1,3-dithiol Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; hexane-1,3-dithiol CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; hexane-1,3-dithiol IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; hexane-1,3-dithiol Traditional Name: 2,2-dimethylolpropane-1,3-diol; hexane-1,3-dithiol Formula: C46H108O8S12 MolecularWeight: 1174.12492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/6C6H14S2.2C5H12O4/c6*1-2-3-6(8)4-5-7;2*6-1-5(2-7,3-8)4-9/h6*6-8H,2-5H2,1H3;2*6-9H,1-4H2