5,6-Dimethoxy-3-oxo-2,3-dihydro-1H-indene-1-carboxylic acid

Base Information

• Chemical Name: 5,6-Dimethoxy-3-oxo-2,3-dihydro-1H-indene-1-carboxylic acid
• CAS No.: 62956-63-2
• Molecular Formula: C12H12O5
• Molecular Weight: 236.224
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID10978802
• Mol file: 62956-63-2.mol

Synonyms:62956-63-2;5,6-Dimethoxy-3-oxo-2,3-dihydro-1H-indene-1-carboxylic acid;5,6-dimethoxy-3-oxo-1,2-dihydroindene-1-carboxylic acid;BRN 2942496;1H-Indene-1-carboxylic acid, 2,3-dihydro-5,6-dimethoxy-3-oxo-;4-10-00-03913 (Beilstein Handbook Reference);DTXSID10978802;MFCD01719621;LS-81629;2,3-Dihydro-5,6-dimethoxy-3-oxo-1H-indene-1-carboxylic acid

Chemical Property of 5,6-Dimethoxy-3-oxo-2,3-dihydro-1H-indene-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.03E-08mmHg at 25°C
• Boiling Point: 445.3°Cat760mmHg
• Flash Point: 176.1°C
• PSA: 72.83000
• Density: 1.347g/cm³
• LogP: 1.45840
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 236.06847348
• Heavy Atom Count: 17
• Complexity: 327

Purity/Quality:

2,3-DIHYDRO-5,6-DIMETHOXY-3-OXO-1H-INDENE-1-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C2C(=O)CC(C2=C1)C(=O)O)OC