1-Ethylhexyl propylphosphonofluoridoate

Base Information

• Chemical Name: 1-Ethylhexyl propylphosphonofluoridoate
• CAS No.: 56922-79-3
• Molecular Formula: C12H22 O2
• Molecular Weight: 198.30188
• European Community (EC) Number: 260-441-1
• DSSTox Substance ID: DTXSID601314567
• Nikkaji Number: J118.168H
• Mol file: 56922-79-3.mol

Synonyms:(Z)-Hex-2-enyl hexanoate;56922-79-3;(Z)-2-Hexenyl hexanoate;EINECS 260-441-1;1-Ethylhexyl propylphosphonofluoridoate;UQPLEMTXCSYMEK-CLFYSBASSA-N;DTXSID601314567;Hexanoic acid (Z)-2-hexenyl ester

Chemical Property of 1-Ethylhexyl propylphosphonofluoridoate

Chemical Property:

• Vapor Pressure: 0.0158mmHg at 25°C
• Boiling Point: 256°Cat760mmHg
• Flash Point: 86.5°C
• PSA: 26.30000
• Density: 0.886g/cm³
• LogP: 3.46620
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 198.161979940
• Heavy Atom Count: 14
• Complexity: 162

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(=O)OCC=CCCC
• Isomeric SMILES: CCCCCC(=O)OC/C=C\CCC