Acetic acid, (pentyloxy)-, 2-butenyl ester

Base Information

• Chemical Name: Acetic acid, (pentyloxy)-, 2-butenyl ester
• CAS No.: 72894-10-1
• Molecular Formula: C11H20O3
• Molecular Weight: 200.28
• DSSTox Substance ID: DTXSID7072628
• Nikkaji Number: J447.239J
• Mol file: 72894-10-1.mol

Synonyms:72894-10-1;Acetic acid, (pentyloxy)-, 2-butenyl ester;Ethanoic acid, pentoxy-, 2-butenyl ester;Acetic acid, 2-(pentyloxy)-, 2-buten-1-yl ester;2-(Pentyloxy)acetic acid 2-butenyl ester;DTXSID7072628

Chemical Property of Acetic acid, (pentyloxy)-, 2-butenyl ester

Chemical Property:

• Vapor Pressure: 0.00849mmHg at 25°C
• Boiling Point: 266.7°C at 760 mmHg
• Flash Point: 91.7°C
• PSA: 35.53000
• Density: 0.937g/cm³
• LogP: 2.31250
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 200.14124450
• Heavy Atom Count: 14
• Complexity: 164

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOCC(=O)OCC=CC
• Isomeric SMILES: CCCCCOCC(=O)OC/C=C/C