Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid;[4-(hydroxymethyl)cyclohexyl]methanol;terephthalic acid

Base Information

• Chemical Name: Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid;[4-(hydroxymethyl)cyclohexyl]methanol;terephthalic acid
• CAS No.: 87871-70-3
• Molecular Formula: C35H50O16
• Molecular Weight: 726.7619
• Mol file: 87871-70-3.mol

Synonyms:(C8-H16-O2.C8-H6-O4.C8-H6-O4.C6-H10-O4.C5-H12-O2)x-;87871-70-3

Chemical Property of Benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid;[4-(hydroxymethyl)cyclohexyl]methanol;terephthalic acid

Chemical Property:

• PSA: 304.72000
• LogP: 3.65660
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 13
• Exact Mass: 726.30988550
• Heavy Atom Count: 51
• Complexity: 580

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CO)CO.C1CC(CCC1CO)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