1,4-Benzenedicarboxylic Acid, Polymer With 2,2-Dimethyl-1,3-Propanediol, 2-Ethyl-2-(Hydroxymethyl)-1,3-Propanediol And 1,6-Hexanediol
[CAS# 68224-13-5]

Identification

• Name: 1,4-Benzenedicarboxylic Acid, Polymer With 2,2-Dimethyl-1,3-Propanediol, 2-Ethyl-2-(Hydroxymethyl)-1,3-Propanediol And 1,6-Hexanediol
• Synonyms: 2,2-Dimethylpropane-1,3-Diol; 2-Ethyl-2-Methylol-Propane-1,3-Diol; Hexane-1,6-Diol; Terephthalic Acid; 1,4-Benzenedicarboxylic Acid, Polymer With 2,2-Dimethyl-1,3-Propanediol, 2-Ethyl-2-(Hydroxymethyl)-1,3-Propanediol And 1,6-Hexanediol
• Molecular Formula: C₂₅H₄₆O₁₁
• Molecular Weight: 522.63
• CAS Registry Number: 68224-13-5
• SMILES: C1=C(C=CC(=C1)C(=O)O)C(=O)O.C(O)C(CO)(CO)CC.C(O)C(CO)(C)C.C(CCCO)CCO
• InChI: 1S/C8H6O4.C6H14O3.C6H14O2.C5H12O2/c9-7(10)5-1-2-6(4-3-5)8(11)12;1-2-6(3-7,4-8)5-9;7-5-3-1-2-4-6-8;1-5(2,3-6)4-7/h1-4H,(H,9,10)(H,11,12);7-9H,2-5H2,1H3;7-8H,1-6H2;6-7H,3-4H2,1-2H3
• InChIKey: QOACQHOVXKUDSZ-UHFFFAOYSA-N

Properties

• Boiling point: 392.4°C at 760 mmHg (Cal.)
• Flash point: 205.3°C (Cal.)