Hexyl (Z)-docos-13-enoate

Base Information

• Chemical Name: Hexyl (Z)-docos-13-enoate
• CAS No.: 19773-56-9
• Molecular Formula: C28H54 O2
• Molecular Weight: 422.72716
• European Community (EC) Number: 243-291-1
• DSSTox Substance ID: DTXSID201311030
• Nikkaji Number: J225.275I
• Mol file: 19773-56-9.mol

Synonyms:Hexyl (Z)-docos-13-enoate;19773-56-9;EINECS 243-291-1;Hexyl(Z)-docos-13-enoate;Hexyl (13Z)-13-docosenoate;DTXSID201311030;(Z)-13-Docosenoic acid hexyl ester

Chemical Property of Hexyl (Z)-docos-13-enoate

Chemical Property:

• Vapor Pressure: 1E-09mmHg at 25°C
• Boiling Point: 489.4°Cat760mmHg
• Flash Point: 74°C
• PSA: 26.30000
• Density: 0.866g/cm³
• LogP: 9.70780
• XLogP3: 12.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 25
• Exact Mass: 422.412380961
• Heavy Atom Count: 30
• Complexity: 362

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCCCCCC(=O)OCCCCCC
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OCCCCCC

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