9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol

Base Information

• Chemical Name: 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol
• CAS No.: 58561-47-0
• Molecular Formula: C23H46O5
• Molecular Weight: 402.6083
• European Community (EC) Number: 261-327-4
• DSSTox Substance ID: DTXSID80974114

Synonyms:EINECS 261-327-4;58561-47-0;9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol;9-Octadecenoic acid, 12-hydroxy-, [R-(Z)]-, ester with 1,2,3-propanetriol;2,3-dihydroxypropyl 5-hydroxy-2-octyldodecanoate;DTXSID80974114

Chemical Property of 9-Octadecenoic acid, 12-hydroxy-, (R-(Z))-, ester with 1,2,3-propanetriol

Chemical Property:

• Vapor Pressure: 1.89E-13mmHg at 25°C
• Boiling Point: 530.1°Cat760mmHg
• Flash Point: 167.3°C
• PSA: 86.99000
• Density: 0.993g/cm³
• LogP: 4.75120
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 21
• Exact Mass: 402.33452456
• Heavy Atom Count: 28
• Complexity: 348

Purity/Quality:

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(CCC(CCCCCCC)O)C(=O)OCC(CO)O

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