2-(5-ethyl-1H-indol-3-yl)acetic acid

Base Information

• Chemical Name: 2-(5-ethyl-1H-indol-3-yl)acetic acid
• CAS No.: 52531-12-1
• Molecular Formula: C12H13NO2
• Molecular Weight: 203.24
• Hs Code.: 2933990090
• ChEMBL ID: CHEMBL397348
• DSSTox Substance ID: DTXSID70568046
• Nikkaji Number: J775.404C
• Wikidata: Q82454175
• Mol file: 52531-12-1.mol

Synonyms:52531-12-1;2-(5-ethyl-1H-indol-3-yl)acetic acid;5-ethylindole-3-acetic acid;5-ET-IAA;CHEMBL397348;SCHEMBL6131655;DTXSID70568046;5-ETHYLINDOLE-3-ACETICACID;MFCD00127887;AKOS022420933;5-Ethyl-1H-Indol-3-Yl)-Acetic Acid;CS-0327072;(5-ETHYL-1H-INDOL-3-YL)ACETIC ACID;D79927;E-7900

Chemical Property of 2-(5-ethyl-1H-indol-3-yl)acetic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.651
• Boiling Point: 425.593 °C at 760 mmHg
• Flash Point: 211.192 °C
• PSA: 53.09000
• Density: 1.254 g/cm³
• LogP: 2.35740
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 203.094628657
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

98%Min ^*data from raw suppliers

5-Ethylindole-3-aceticAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC2=C(C=C1)NC=C2CC(=O)O