Ethyl 2-(butan-2-yl)benzoate

Base Information

• Chemical Name: Ethyl 2-(butan-2-yl)benzoate
• CAS No.: 5133-56-2
• Molecular Formula: C13H18O2
• Molecular Weight: 206.2808
• NSC Number: 122584
• DSSTox Substance ID: DTXSID30298332
• Nikkaji Number: J2.523.745E

Synonyms:5133-56-2;ethyl 2-(butan-2-yl)benzoate;NSC122584;SCHEMBL1789940;DTXSID30298332;NSC-122584

Chemical Property of Ethyl 2-(butan-2-yl)benzoate

Chemical Property:

• Vapor Pressure: 0.00279mmHg at 25°C
• Boiling Point: 285.5°C at 760 mmHg
• Flash Point: 126.6°C
• Density: 0.98g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 206.130679813
• Heavy Atom Count: 15
• Complexity: 201

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C1=CC=CC=C1C(=O)OCC

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