((3-(2-aminoethyl)-1H-indol-5-yl)oxy)(oxo)acetic acid

Base Information

• Chemical Name: ((3-(2-aminoethyl)-1H-indol-5-yl)oxy)(oxo)acetic acid
• CAS No.: 319-71-1
• Molecular Formula: C12H12 N2 O4
• Molecular Weight: 248.2347
• NSC Number: 115625
• DSSTox Substance ID: DTXSID40297336
• Wikidata: Q82038375
• ChEMBL ID: CHEMBL1562337
• Mol file: 319-71-1.mol

Synonyms:NSC115625;319-71-1;NSC-115625;NCIStruc1_000888;NCIStruc2_000807;CHEMBL1562337;((3-(2-aminoethyl)-1H-indol-5-yl)oxy)(oxo)acetic acid;DTXSID40297336;CCG-38148;NCGC00014156;NCI115625;NCGC00014156-02;NCGC00097265-01;NCI60_000353

Chemical Property of ((3-(2-aminoethyl)-1H-indol-5-yl)oxy)(oxo)acetic acid

Chemical Property:

• Vapor Pressure: 1.24E-11mmHg at 25°C
• Boiling Point: 519.8°C at 760 mmHg
• Flash Point: 268.2°C
• Density: 1.454g/cm³
• XLogP3: -2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 248.07970687
• Heavy Atom Count: 18
• Complexity: 334

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1OC(=O)C(=O)O)C(=CN2)CCN