1-Octylindole

Base Information

• Chemical Name: 1-Octylindole
• CAS No.: 42951-63-3
• Molecular Formula: C16H23N
• DSSTox Substance ID: DTXSID70510883
• Nikkaji Number: J3.387.709I
• Wikidata: Q82369429
• Mol file: 42951-63-3.mol

Synonyms:1-octylindole;1-(n-octyl)indole;1-Octyl-1H-indole;42951-63-3;SCHEMBL4976386;DTXSID70510883;VOWUHKQBOIRNJT-UHFFFAOYSA-N;AKOS013123390;10.14272/VOWUHKQBOIRNJT-UHFFFAOYSA-N;10.14272/VOWUHKQBOIRNJT-UHFFFAOYSA-N.2;doi:10.14272/VOWUHKQBOIRNJT-UHFFFAOYSA-N.1;doi:10.14272/VOWUHKQBOIRNJT-UHFFFAOYSA-N.2

Chemical Property of 1-Octylindole

Chemical Property:

• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 7
• Exact Mass: 229.183049738
• Heavy Atom Count: 17
• Complexity: 202

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCN1C=CC2=CC=CC=C21