2-Hexenyl phenylacetate

Base Information

• Chemical Name: 2-Hexenyl phenylacetate
• CAS No.: 71605-86-2
• Molecular Formula: C14H18 O2
• Molecular Weight: 218.29152
• European Community (EC) Number: 275-666-0,268-705-8
• DSSTox Substance ID: DTXSID90887180
• Nikkaji Number: J289.228F,J208.916E
• Wikidata: Q63392237
• Mol file: 71605-86-2.mol

Synonyms:68133-78-8;2-Hexenyl phenylacetate;Phenylacetic Acid trans-2-Hexen-1-yl Ester;[(E)-hex-2-enyl] 2-phenylacetate;trans-2-Hexenyl phenylacetate;71605-86-2;EINECS 275-666-0;Benzeneacetic acid, (2E)-2-hexenyl ester;(E)-Hex-2-enyl phenylacetate;Benzeneacetic acid, 2-hexenyl ester, (E)-;Benzeneacetic acid, (2E)-2-hexen-1-yl ester;EINECS 268-705-8;trans-2-Hexen-1-yl Phenylacetate ,;trans-2-Hexen-1-yl Phenylacetate;(E) - hex - 2 - enyl phenylacetate;(E)-2-Hexenyl=phenylacetate;DTXSID90887180;(2E)-2-Hexenyl phenylacetate #;(E)-hex-2-enyl 2-phenylacetate;BYGAPGDXGHDYGP-XBXARRHUSA-N;Benzeneacetic acid 2-hexenyl ester;MFCD00036543;P1045;Q63392237

Chemical Property of 2-Hexenyl phenylacetate

Chemical Property:

• Vapor Pressure: 0.000644mmHg at 25°C
• Boiling Point: 309.3°C at 760 mmHg
• Flash Point: 119.4°C
• Density: 0.999g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 218.130679813
• Heavy Atom Count: 16
• Complexity: 215

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC=CCOC(=O)CC1=CC=CC=C1
• Isomeric SMILES: CCC/C=C/COC(=O)CC1=CC=CC=C1