1-Phenylethyl 3-diethoxyphosphoryloxybut-2-enoate

Base Information

• Chemical Name: 1-Phenylethyl 3-diethoxyphosphoryloxybut-2-enoate
• CAS No.: 27591-74-8
• Molecular Formula: C16H23 O6 P
• Molecular Weight: 342.32
• DSSTox Substance ID: DTXSID701031097
• Mol file: 27591-74-8.mol

Synonyms:DTXSID701031097

Chemical Property of 1-Phenylethyl 3-diethoxyphosphoryloxybut-2-enoate

Chemical Property:

• Vapor Pressure: 1.92E-06mmHg at 25°C
• Boiling Point: 394.9°C at 760 mmHg
• Flash Point: 206.1°C
• PSA: 80.87000
• Density: 1.159g/cm³
• LogP: 4.39230
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 342.12322545
• Heavy Atom Count: 23
• Complexity: 432

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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