2-Phenylethyl 2-ethylbutyrate

Base Information

• Chemical Name: 2-Phenylethyl 2-ethylbutyrate
• CAS No.: 6315-04-4
• Molecular Formula: C14H20 O2
• Molecular Weight: 220.3074
• European Community (EC) Number: 228-643-4
• NSC Number: 20052
• UNII: BAJ002YBN2
• DSSTox Substance ID: DTXSID3064225
• Nikkaji Number: J206.903B
• Wikidata: Q81991354
• Mol file: 6315-04-4.mol

Synonyms:2-Phenylethyl 2-ethylbutyrate;2-phenylethyl 2-ethylbutanoate;6315-04-4;phenethyl 2-ethylbutanoate;BAJ002YBN2;Butanoic acid, 2-ethyl-, 2-phenylethyl ester;Diethylacetic acid, phenylethyl ester;NSC-20052;Phenethyl 2-ethylbutyrate;phenethyl diethylacetate;UNII-BAJ002YBN2;SCHEMBL585944;DTXSID3064225;NSC20052;EINECS 228-643-4;2-Ethylbutyric acid, phenethyl ester;NSC 20052;AKOS017182082;2-Ethylbutanoic acid 2-phenylethyl ester

Chemical Property of 2-Phenylethyl 2-ethylbutyrate

Chemical Property:

• Vapor Pressure: 0.00121mmHg at 25°C
• Boiling Point: 299.2°C at 760 mmHg
• Flash Point: 109.6°C
• PSA: 26.30000
• Density: 0.978g/cm³
• LogP: 3.20850
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 220.146329876
• Heavy Atom Count: 16
• Complexity: 191

Purity/Quality:

99% ^*data from raw suppliers

2-ETHYL-2-PHENYLETHYL BUTANOIC ACID ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)C(=O)OCCC1=CC=CC=C1

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