Benzene-1,3-dicarboxylic acid;benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;2,2,4-trimethylpentane-1,3-diol

Base Information

• Chemical Name: Benzene-1,3-dicarboxylic acid;benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;2,2,4-trimethylpentane-1,3-diol
• CAS No.: 68647-13-2
• Molecular Formula: C35H54O15
• Molecular Weight: 714.79426
• Mol file: 68647-13-2.mol

Synonyms:68647-13-2;(C8-H18-O2.C8-H6-O4.C6-H14-O3.C6-H10-O4)x-.x-C7-H6-O2

Chemical Property of Benzene-1,3-dicarboxylic acid;benzoic acid;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexanedioic acid;2,2,4-trimethylpentane-1,3-diol

Chemical Property:

• PSA: 287.65000
• LogP: 3.56530
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 15
• Exact Mass: 714.34627101
• Heavy Atom Count: 50
• Complexity: 554

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CO)(CO)CO.CC(C)C(C(C)(C)CO)O.C1=CC=C(C=C1)C(=O)O.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O

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