2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid

Base Information

• Chemical Name: 2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid
• CAS No.: 843621-27-2
• Molecular Formula: C15H16O5
• Molecular Weight: 276.28
• DSSTox Substance ID: DTXSID70349812
• ChEMBL ID: CHEMBL1311625
• Mol file: 843621-27-2.mol

Synonyms:843621-27-2;2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid;2-((4-Ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy)propanoic acid;2-(4-ethyl-7-methyl-2-oxochromen-5-yl)oxypropanoic acid;SMR000043989;MLS000082872;MFCD03848272;HMS2396P17;cid_663272;CHEMBL1311625;BDBM52124;DTXSID70349812;2-(4-ETHYL-7-METHYL-2-OXO-2H-CHROMEN-5-YLOXY)-PROPIONIC ACID;2-[(4-Ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-propanoic acid;BBL030150;STK991552;AKOS004939011;NCGC00067896-02;VS-09642;FT-0684284;EN300-302742;AB00394745-09;2-(4-ethyl-2-keto-7-methyl-chromen-5-yl)oxypropionic acid;2-((4-Ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy)propanoicacid;2-(4-ethyl-7-methyl-2-oxidanylidene-chromen-5-yl)oxypropanoic acid;2-[(4-ethyl-7-methyl-2-oxo-1-benzopyran-5-yl)oxy]propanoic acid;2-[(4-Ethyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl)oxy]propanoic acid

Chemical Property of 2-[(4-ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]propanoic acid

Chemical Property:

• Vapor Pressure: 2.6E-10mmHg at 25°C
• Boiling Point: 487.3°C at 760 mmHg
• PKA: 3.04±0.10(Predicted)
• Flash Point: 183.9°C
• PSA: 76.74000
• Density: 1.25g/cm³
• LogP: 2.51570
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 276.09977361
• Heavy Atom Count: 20
• Complexity: 428

Purity/Quality:

98%min ^*data from raw suppliers

2-[(4-Ethyl-7-methyl-2-oxo-2H-chromen-5-yl)oxy]-propanoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(C)C(=O)O