Oleylsarcosine, calcium salt

Base Information

• Chemical Name: Oleylsarcosine, calcium salt
• CAS No.: 16026-16-7
• Deprecated CAS: 84435-19-8
• Molecular Formula: C21H39 N O3 . 1/2 Ca
• Molecular Weight: 745.14064
• European Community (EC) Number: 240-166-3
• DSSTox Substance ID: DTXSID9065996
• Nikkaji Number: J219.945I
• Mol file: 16026-16-7.mol

Synonyms:Oleylsarcosine, calcium salt;16026-16-7;N-oleoylsarcosine acid calcium salt;Calcium bis[(Z)-N-methyl-N-(1-oxo-9-octadecenyl)aminoacetate];EINECS 240-166-3;calcium;2-[methyl-[(Z)-octadec-9-enoyl]amino]acetate;Calcium bis((Z)-N-methyl-N-(1-oxo-9-octadecenyl)aminoacetate);Glycine, N-methyl-N-((9Z)-1-oxo-9-octadecenyl)-, calcium salt;Glycine, N-methyl-N-((9Z)-1-oxo-9-octadecen-1-yl)-, calcium salt (2:1);Glycine, N-methyl-N-[(9Z)-1-oxo-9-octadecenyl]-, calcium salt;SCHEMBL5173355;DTXSID9065996;C21H39NO3.1/2Ca;C21-H39-N-O3.1/2Ca;W-107979;Bis[N-methyl-N-[(Z)-1-oxo-9-octadecenyl]glycine] calcium salt;Glycine, N-methyl-N-(1-oxo-9-octadecenyl)-, calcium salt, (Z)-

Chemical Property of Oleylsarcosine, calcium salt

Chemical Property:

• Vapor Pressure: 0.6Pa at 25℃
• Boiling Point: 499.4°Cat760mmHg
• Flash Point: 255.9°C
• PSA: 120.88000
• Density: g/cm³
• LogP: 8.46440
• Water Solubility.: 45mg/L at 20℃
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 32
• Exact Mass: 744.5329290
• Heavy Atom Count: 51
• Complexity: 361

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)N(C)CC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)N(C)CC(=O)[O-].[Ca+2]
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)N(CC(=O)[O-])C.CCCCCCCC/C=C\CCCCCCCC(=O)N(CC(=O)[O-])C.[Ca+2]