7-hydroxy-4-oxo-8-propyl-4H-chromene-2-carboxylic acid

Base Information

• Chemical Name: 7-hydroxy-4-oxo-8-propyl-4H-chromene-2-carboxylic acid
• CAS No.: 105212-09-7
• Molecular Formula: C13H12 O5
• Molecular Weight: 248.23
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID40384275
• Wikidata: Q82176284
• Mol file: 105212-09-7.mol

Synonyms:105212-09-7;7-hydroxy-4-oxo-8-propyl-4H-chromene-2-carboxylic acid;7-hydroxy-4-oxo-8-propylchromene-2-carboxylic acid;Maybridge1_002042;Oprea1_606447;HMS547E18;DTXSID40384275;MFCD00100375;CCG-235220;FT-0642583;W-204550;7-HYDROXY-4-OXO-8-PROPYL-4H-CHROMENE-2-CARBOXYLICACID

Chemical Property of 7-hydroxy-4-oxo-8-propyl-4H-chromene-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 2.3E-09mmHg at 25°C
• Melting Point: 264 °C
• Refractive Index: 1.625
• Boiling Point: 462.9°Cat760mmHg
• PKA: 2.29±0.20(Predicted)
• Flash Point: 180.9°C
• PSA: 87.74000
• Density: 1.417g/cm³
• LogP: 2.14930
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 248.06847348
• Heavy Atom Count: 18
• Complexity: 387

Purity/Quality:

98%min ^*data from raw suppliers

7-Hydroxy-4-oxo-8-propyl-4h-chromene-2-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:
• Hazard Codes: R36/37/38:
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=C(C=CC2=C1OC(=CC2=O)C(=O)O)O