Methyl 2-acetoxy-5-acetylbenzoate

Base Information

• Chemical Name: Methyl 2-acetoxy-5-acetylbenzoate
• CAS No.: 61414-18-4
• Molecular Formula: C12H12O5
• Molecular Weight: 236.22100
• DSSTox Substance ID: DTXSID60456665
• Nikkaji Number: J1.268.303K
• Wikidata: Q82279219
• Mol file: 61414-18-4.mol

Synonyms:methyl 2-acetoxy-5-acetylbenzoate;61414-18-4;methyl 5-acetyl-2-acetyloxybenzoate;methyl2-acetoxy-5-acetylbenzoate;SCHEMBL13897134;DTXSID60456665;CS-M1165;AKOS037649758;CS-13588;2-Acetoxy-5-acetylbenzoic acid methyl ester

Chemical Property of Methyl 2-acetoxy-5-acetylbenzoate

Chemical Property:

• Boiling Point: 360.7±32.0 °C(Predicted)
• PSA: 69.67000
• Density: 1.202±0.06 g/cm3(Predicted)
• LogP: 1.60110
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 236.06847348
• Heavy Atom Count: 17
• Complexity: 323

Purity/Quality:

≥95% ^*data from raw suppliers

methyl2-acetoxy-5-acetylbenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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