Methyl (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoate

Base Information

• Chemical Name: Methyl (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoate
• CAS No.: 28061-46-3
• Molecular Formula: C23H34O2
• Molecular Weight: 342.51
• Mol file: 28061-46-3.mol

Synonyms:docosahexaenoic acid methyl ester;methyl docosahexaenoate

Chemical Property of Methyl (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoate

Chemical Property:

• Boiling Point: 468.6°Cat760mmHg
• Flash Point: 257.2°C
• PSA: 26.30000
• Density: 0.917g/cm³
• LogP: 6.63730
• XLogP3: 8.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 342.255880323
• Heavy Atom Count: 25
• Complexity: 476

Purity/Quality:

98%,99%, ^*data from raw suppliers

all-cis-4,7,10,13,16,19-Docosahexaenoic acid methyl ester analytical standard ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,Xn,N
• Hazard Codes: F,Xn,N
• Statements: 11-38-50/53-65-67
• Safety Statements: 16-61-62

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)OC
• Isomeric SMILES: CCCCCCCCC/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)OC