3-Oxo-3,4-dihydro-1h-isochromene-1-carboxylic acid

Base Information

• Chemical Name: 3-Oxo-3,4-dihydro-1h-isochromene-1-carboxylic acid
• CAS No.: 55630-93-8
• Molecular Formula: C10H8 O4
• Molecular Weight: 192.1681
• NSC Number: 121609
• DSSTox Substance ID: DTXSID80298221

Synonyms:55630-93-8;3-oxo-3,4-dihydro-1h-isochromene-1-carboxylic acid;NSC121609;DTXSID80298221;3-Oxoisochromane-1-carboxylic acid;NSC-121609

Chemical Property of 3-Oxo-3,4-dihydro-1h-isochromene-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 3.97E-10mmHg at 25°C
• Boiling Point: 482.7°Cat760mmHg
• Flash Point: 202.3°C
• Density: 1.412g/cm³
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 192.04225873
• Heavy Atom Count: 14
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC=CC=C2C(OC1=O)C(=O)O

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