AC1L5BLO

benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;ethane-1,2-diol;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;terephthalic acid

Also Known As: 1,3-Benzenedicarboxylic acid, polymer with 1,4-benzenedicarboxylic acid, 2,2-dimethyl-1,3-propanediol, 1,2-ethanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol and hexanedioic acid|benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; ethane-1,2-diol; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexanedioic acid; terephthalic acid|(C8-H6-O4.C8-H6-O4.C6-H14-O3.C6-H10-O4.C5-H12-O2.C2-H6-O2)x-

Molecular Formula	C35H54O19
Molecular Weight	778.3259 g/mol
LogP	1.2099
Topological Polar Surface Area	365.0 Ų
Hydrogen Bond Donors	13
Hydrogen Bond Acceptors	19
Rotatable Bonds	16
Exact Mass	778.3259
Monoisotopic Mass	778.3259
Heavy Atoms	54
Complexity	573.0

Chemical Identifiers

CAS Number	90144-49-3
SMILES	CCC(CO)(CO)CO.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C1=CC(=CC=C1C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O.C(CO)O
InChIKey	MEFFZZHVMBVDIX-UHFFFAOYSA-N