2-Heptadecylidene-4-hexadecyloxetan-3-one

Base Information

• Chemical Name: 2-Heptadecylidene-4-hexadecyloxetan-3-one
• CAS No.: 94109-14-5
• Molecular Formula: C36H68 O2
• Molecular Weight: 532.92392
• European Community (EC) Number: 302-452-7
• UNII: DVS3ICM1DX
• DSSTox Substance ID: DTXSID6029838
• Wikidata: Q27276631
• Mol file: 94109-14-5.mol

Synonyms:DVS3ICM1DX;UNII-DVS3ICM1DX;94109-14-5;2-Heptadecylidene-4-hexadecyloxetan-3-one;EINECS 302-452-7;DTXSID6029838;2-Heptadecylidene-4-hexadecyl-3-oxetanone;3-OXETANONE, 2-HEPTADECYLIDENE-4-HEXADECYL-;Q27276631

Chemical Property of 2-Heptadecylidene-4-hexadecyloxetan-3-one

Chemical Property:

• Vapor Pressure: 5.9E-15mmHg at 25°C
• Boiling Point: 612.8°Cat760mmHg
• Flash Point: 174.9°C
• PSA: 26.30000
• Density: 0.9g/cm³
• LogP: 12.58100
• XLogP3: 17.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 30
• Exact Mass: 532.52193141
• Heavy Atom Count: 38
• Complexity: 538

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCC=C1C(=O)C(O1)CCCCCCCCCCCCCCCC