(2E)-3-(1H-indol-2-yl)prop-2-enoic acid

Base Information

• Chemical Name: (2E)-3-(1H-indol-2-yl)prop-2-enoic acid
• CAS No.: 143618-94-4
• Molecular Formula: C11H9NO2
• Molecular Weight: 187.198
• DSSTox Substance ID: DTXSID001335971
• Nikkaji Number: J1.001.350J
• Wikidata: Q27162470
• Mol file: 143618-94-4.mol

Synonyms:(2E)-3-(1H-indol-2-yl)prop-2-enoic acid;143618-94-4;(E)-3-(1H-indol-2-yl)prop-2-enoic acid;(E)-3-(indol-2-yl)acrylic acid;(E)-3-(1H-indol-2-yl)acrylic acid;2-indoleacrylic acid;2-indolylacrylic acid;indole-2-acrylic acid;trans-indoleacrylic acid;trans-2-indoleacrylic acid;3-(2-indolyl)acrylic acid;SCHEMBL179872;CHEBI:90333;3-(1H-indol-2-yl)acrylic acid;DTXSID001335971;AKOS024170710;3-(1H-indol-2-yl)prop-2-enoic acid;VS-14073;NS00015052;EN300-1842633;AO-022/43514509;Q27162470

Chemical Property of (2E)-3-(1H-indol-2-yl)prop-2-enoic acid

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 187.063328530
• Heavy Atom Count: 14
• Complexity: 250

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(N2)C=CC(=O)O
• Isomeric SMILES: C1=CC=C2C(=C1)C=C(N2)/C=C/C(=O)O