2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethyloxy)phenoxy]ethanol; terephthalic acid

Systemtic Name: 2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethyloxy)phenoxy]ethanol; terephthalic acid Openeye Name: 2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethoxy)phenoxy]ethanol; terephthalic acid CAS Name: 2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethoxy)phenoxy]ethanol; terephthalic acid IUPAC Name: 2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethoxy)phenoxy]ethanol; terephthalic acid Traditional Name: 2,2-dimethylpropane-1,3-diol; 2-[4-(2-hydroxyethoxy)phenoxy]ethanol; terephthalic acid Formula: C23H32O10 MolecularWeight: 468.49418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=CC=C1OCCO)OCCO

Isomeric SMILES

CC(C)(CO)CO.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=CC=C1OCCO)OCCO

InChI

InChI=1S/C10H14O4.C8H6O4.C5H12O2/c11-5-7-13-9-1-2-10(4-3-9)14-8-6-12;9-7(10)5-1-2-6(4-3-5)8(11)12;1-5(2,3-6)4-7/h1-4,11-12H,5-8H2;1-4H,(H,9,10)(H,11,12);6-7H,3-4H2,1-2H3