3-Acetyloxybutyl acetate;hexanedioic acid

Base Information

• Chemical Name: 3-Acetyloxybutyl acetate;hexanedioic acid
• CAS No.: 67989-20-2
• Molecular Formula: C14H24O8
• Molecular Weight: 320.3356
• DSSTox Substance ID: DTXSID70987399
• Mol file: 67989-20-2.mol

Synonyms:67989-20-2;DTXSID70987399;Hexanedioic acid--butane-1,3-diyl diacetate (1/1)

Chemical Property of 3-Acetyloxybutyl acetate;hexanedioic acid

Chemical Property:

• Vapor Pressure: 0.0722mmHg at 25°C
• Boiling Point: 228.8°C at 760 mmHg
• Flash Point: 102.6°C
• PSA: 127.20000
• LogP: 1.60720
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 320.14711772
• Heavy Atom Count: 22
• Complexity: 278

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CCOC(=O)C)OC(=O)C.C(CCC(=O)O)CC(=O)O

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