2-(4-Iodo-2-nitrophenyl)acetic acid

Base Information

• Chemical Name: 2-(4-Iodo-2-nitrophenyl)acetic acid
• CAS No.: 1261853-80-8
• Molecular Formula: C8H6INO4
• Molecular Weight: 307.04
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID30607687
• Wikidata: Q72484164
• Mol file: 1261853-80-8.mol

Synonyms:2-(4-Iodo-2-nitrophenyl)acetic acid;1261853-80-8;(4-Iodo-2-nitrophenyl)acetic acid;SCHEMBL10695110;DTXSID30607687;2-(4-Iodo-2-nitrophenyl)aceticacid;DB-226625;AM20120646

Chemical Property of 2-(4-Iodo-2-nitrophenyl)acetic acid

Chemical Property:

• Boiling Point: 393.8±27.0 °C(Predicted)
• PKA: 3.84±0.10(Predicted)
• PSA: 83.12000
• Density: 2.036±0.06 g/cm3(Predicted)
• LogP: 2.34970
• Storage Temp.: 2-8°C
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 306.93416
• Heavy Atom Count: 14
• Complexity: 240

Purity/Quality:

98% ^*data from raw suppliers

2-(4-Iodo-2-nitrophenyl)aceticacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1I)[N+](=O)[O-])CC(=O)O