2,2-dimethylpropane-1,3-diol; hexane-1,6-diol; 2-(hydroxymethyl)-2-methyl-propane-1,3-diol; isophthalic acid

More details:

• Systematic name

  2,2-dimethylpropane-1,3-diol; hexane-1,6-diol; 2-(hydroxymethyl)-2-methyl-propane-1,3-diol; isophthalic acid

• SMILES

  CC(C)(CO)CO.CC(CO)(CO)CO.c1cc(cc(c1)C(=O)O)C(=O)O.C(CCCO)CCO

• Std. InChi

  InChI=1S/C8H6O4.C6H14O2.C5H12O3.C5H12O2/c9-7(10)5-2-1-3-6(4-5)8(11)12;7-5-3-1-2-4-6-8;1-5(2-6,3-7)4-8;1-5(2,3-6)4-7/h1-4H,(H,9,10)(H,11,12);7-8H,1-6H2;6-8H,2-4H2,1H3;6-7H,3-4H2,1-2H3

• Std. InChIKey

  GIQRZDSNTTXIPV-UHFFFAOYSA-N

• Cite this record

  CSID:151466, http://www.chemspider.com/Chemical-Structure.151466.html (accessed 00:25, May 18, 2024)