Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;ethane-1,2-diol;hexanedioic acid;terephthalic acid

Base Information

• Chemical Name: Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;ethane-1,2-diol;hexanedioic acid;terephthalic acid
• CAS No.: 40471-09-8
• Molecular Formula: C29H40O16
• Molecular Weight: 644.6183
• European Community (EC) Number: 690-658-0
• Mol file: 40471-09-8.mol

Synonyms:(C8-H6-O4.C8-H6-O4.C6-H10-O4.C5-H12-O2.C2-H6-O2)x-;40471-09-8

Chemical Property of Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;ethane-1,2-diol;hexanedioic acid;terephthalic acid

Chemical Property:

• Boiling Point: 392.4°Cat760mmHg
• Flash Point: 205.3°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 12
• Exact Mass: 644.23163518
• Heavy Atom Count: 45
• Complexity: 512

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: 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

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