2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 3-methyloctane-4,4-diol

Systemtic Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 3-methyloctane-4,4-diol Openeye Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 3-methyloctane-4,4-diol CAS Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 3-methyloctane-4,4-diol IUPAC Name: 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; 3-methyloctane-4,4-diol Traditional Name: 2-ethyl-2-methylol-propane-1,3-diol; 3-methyloctane-4,4-diol Formula: C21H48O8 MolecularWeight: 428.60102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC)(O)O.CCC(CO)(CO)CO.CCC(CO)(CO)CO

Isomeric SMILES

CCCCC(C(C)CC)(O)O.CCC(CO)(CO)CO.CCC(CO)(CO)CO

InChI

InChI=1S/C9H20O2.2C6H14O3/c1-4-6-7-9(10,11)8(3)5-2;2*1-2-6(3-7,4-8)5-9/h8,10-11H,4-7H2,1-3H3;2*7-9H,2-5H2,1H3