7-(4-Octylphenyl)hept-5-ynoic acid

Base Information

• Chemical Name: 7-(4-Octylphenyl)hept-5-ynoic acid
• CAS No.: 88255-10-1
• Molecular Formula: C21H30O2
• DSSTox Substance ID: DTXSID00607997
• Wikidata: Q82507104
• Mol file: 88255-10-1.mol

Synonyms:7-(4-OCTYLPHENYL)HEPT-5-YNOIC ACID;88255-10-1;SCHEMBL11142006;DTXSID00607997;GYNUTUSQJOMGOD-UHFFFAOYSA-N;7-[p-(n-octyl)phenyl]hept-5-ynoic acid

Chemical Property of 7-(4-Octylphenyl)hept-5-ynoic acid

Chemical Property:

• XLogP3: 6.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 11
• Exact Mass: 314.224580195
• Heavy Atom Count: 23
• Complexity: 366

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC1=CC=C(C=C1)CC#CCCCC(=O)O