Isooctadecanoic acid, 1,1'-(2,2-dimethyl-1,3-propanediyl) ester

Base Information

• Chemical Name: Isooctadecanoic acid, 1,1'-(2,2-dimethyl-1,3-propanediyl) ester
• CAS No.: 109884-54-0
• Molecular Formula: C41H80 O4
• Molecular Weight: 637.0715
• European Community (EC) Number: 807-674-2
• UNII: 4M6OQ34JWW
• Wikidata: Q27260083
• RXCUI: 1367136
• Mol file: 109884-54-0.mol

Synonyms:Neopentyl glycol disostearate;109884-54-0;Neopentyl glycol diisooctadecanoate;UNII-4M6OQ34JWW;Isooctadecanoic acid, 1,1'-(2,2-dimethyl-1,3-propanediyl) ester;4M6OQ34JWW;neopentyl glycol diisostearate;Isooctadecanoic acid, 2,2-dimethyl-1,3-propanediyl ester;[2,2-dimethyl-3-(16-methylheptadecanoyloxy)propyl] 16-methylheptadecanoate;NEOPENTYL GLYCOL DIISOSTEARATE [INCI];Q27260083

Chemical Property of Isooctadecanoic acid, 1,1'-(2,2-dimethyl-1,3-propanediyl) ester

Chemical Property:

• Vapor Pressure: 0-0Pa at 20℃
• Boiling Point: 400℃ at 101.3kPa
• PSA: 52.60000
• Density: 0.879-0.899g/cm3 at 20-50℃
• LogP: 13.33380
• XLogP3: 17.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 36
• Exact Mass: 636.60566103
• Heavy Atom Count: 45
• Complexity: 600

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCCCCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCCCCCCCCCC(C)C

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