1H-Indole-3-acetic acid, 1-ethyl-, ethyl ester

Base Information

• Chemical Name: 1H-Indole-3-acetic acid, 1-ethyl-, ethyl ester
• CAS No.: 100717-88-2
• Molecular Formula: C₁₄H₁₇NO₂
• Molecular Weight: 231.294
• DSSTox Substance ID: DTXSID90472898
• Wikidata: Q82302090
• Mol file: 100717-88-2.mol

Synonyms:1H-Indole-3-acetic acid, 1-ethyl-, ethyl ester;DTXSID90472898

Chemical Property of 1H-Indole-3-acetic acid, 1-ethyl-, ethyl ester

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 231.125928785
• Heavy Atom Count: 17
• Complexity: 267

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C=C(C2=CC=CC=C21)CC(=O)OCC

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