4-(Indolin-5-yl)benzoic acid

Base Information

• Chemical Name: 4-(Indolin-5-yl)benzoic acid
• CAS No.: 889953-90-6
• Molecular Formula: C15H13 N O2
• Molecular Weight: 239.27
• DSSTox Substance ID: DTXSID70602378
• Wikidata: Q82499405
• Mol file: 889953-90-6.mol

Synonyms:889953-90-6;4-(Indolin-5-yl)benzoic acid;Benzoic acid,4-(2,3-dihydro-1H-indol-5-yl)-;DTXSID70602378;AKOS004113899;4-(2,3-dihydro-1H-indol-5-yl)benzoic acid

Chemical Property of 4-(Indolin-5-yl)benzoic acid

Chemical Property:

• PSA: 49.33000
• LogP: 3.15780
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 239.094628657
• Heavy Atom Count: 18
• Complexity: 310

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNC2=C1C=C(C=C2)C3=CC=C(C=C3)C(=O)O

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