Methyl gadoleate

Base Information

• Chemical Name: Methyl gadoleate
• CAS No.: 67810-35-9
• Molecular Formula: C₂₁H₄₀O₂
• Molecular Weight: 324.547
• UNII: POU3PPS30J
• DSSTox Substance ID: DTXSID60880385
• Nikkaji Number: J667.965J
• Wikidata: Q27893787

Synonyms:methyl gadoleate;Eicosenoic acid, methyl ester, (Z)-;Methyl 9-eicosenoate;POU3PPS30J;76899-35-9;67810-35-9;UNII-POU3PPS30J;methyl (Z)-icos-9-enoate;SCHEMBL17747586;DTXSID60880385;9-Eicosenoic acid, methyl ester, (Z)-;9(Z)-EICOSENOIC ACID METHYL ESTER;Q27893787

Chemical Property of Methyl gadoleate

Chemical Property:

• XLogP3: 8.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 324.302830514
• Heavy Atom Count: 23
• Complexity: 271

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCC=CCCCCCCCC(=O)OC
• Isomeric SMILES: CCCCCCCCCC/C=C\CCCCCCCC(=O)OC

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