Isotridecyl 2-ethylhexanoate

Base Information

• Chemical Name: Isotridecyl 2-ethylhexanoate
• CAS No.: 84962-29-8
• Molecular Formula: C21H42O2
• Molecular Weight: 326.55698
• European Community (EC) Number: 284-726-5
• DSSTox Substance ID: DTXSID401005247
• Mol file: 84962-29-8.mol

Synonyms:Isotridecyl 2-ethylhexanoate;84962-29-8;EINECS 284-726-5;11-METHYLDODECYL 2-ETHYLHEXANOATE;SCHEMBL8567093;SCFVTLHTOPTVRW-UHFFFAOYSA-N;DTXSID401005247

Chemical Property of Isotridecyl 2-ethylhexanoate

Chemical Property:

• PSA: 26.30000
• LogP: 6.91290
• XLogP3: 8.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 17
• Exact Mass: 326.318480578
• Heavy Atom Count: 23
• Complexity: 261

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)C(=O)OCCCCCCCCCCC(C)C