butane-1,3-diol; 2,2-dimethylpropane-1,3-diol

Systemtic Name: butane-1,3-diol; 2,2-dimethylpropane-1,3-diol Openeye Name: butane-1,3-diol; 2,2-dimethylpropane-1,3-diol CAS Name: butane-1,3-diol; 2,2-dimethylpropane-1,3-diol IUPAC Name: butane-1,3-diol; 2,2-dimethylpropane-1,3-diol Traditional Name: butane-1,3-diol; 2,2-dimethylpropane-1,3-diol Formula: C9H22O4 MolecularWeight: 194.26858

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)O.CC(C)(CO)CO

Isomeric SMILES

CC(CCO)O.CC(C)(CO)CO

InChI

InChI=1S/C5H12O2.C4H10O2/c1-5(2,3-6)4-7;1-4(6)2-3-5/h6-7H,3-4H2,1-2H3;4-6H,2-3H2,1H3