1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, ar,ar'-diethyl ester

Base Information

• Chemical Name: 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, ar,ar'-diethyl ester
• CAS No.: 51018-94-1
• Deprecated CAS: 34012-75-4,143454-55-1,152880-26-7,37338-12-8,50853-35-5,50986-39-5,51063-33-3,72252-63-2,152880-26-7,37338-12-8,50853-35-5,50986-39-5,51063-33-3,72252-63-2
• Molecular Formula: C21H18O9
• Molecular Weight: 414.3622
• DSSTox Substance ID: DTXSID4068610
• Nikkaji Number: J1.112.217E
• Wikidata: Q81995370
• Mol file: 51018-94-1.mol

Synonyms:1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, ar,ar'-diethyl ester;51018-94-1;SCHEMBL1898128;DTXSID4068610;4,5'-Carbonylbis[2-(ethoxycarbonyl)benzoic acid]

Chemical Property of 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, ar,ar'-diethyl ester

Chemical Property:

• Vapor Pressure: 1.23E-18mmHg at 25°C
• Boiling Point: 665.9°C at 760 mmHg
• Flash Point: 234.9°C
• Density: 1.374g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 10
• Exact Mass: 414.09508215
• Heavy Atom Count: 30
• Complexity: 686

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(C=C(C=C1)C(=O)C2=CC(=C(C=C2)C(=O)O)C(=O)OCC)C(=O)O

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