3-(Trifluoromethyl)isatoic anhydride

Base Information

• Chemical Name: 3-(Trifluoromethyl)isatoic anhydride
• CAS No.: 72985-50-3
• Molecular Formula: C₉H₄F₃NO₃
• Molecular Weight: 231.131
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID701217841
• Mol file: 72985-50-3.mol

Synonyms:72985-50-3;3-(Trifluoromethyl)isatoic anhydride;8-(trifluoromethyl)-1H-benzo[d][1,3]oxazine-2,4-dione;DTXSID701217841;XCA98550;MFCD18251388;AKOS012410244;PS-10614;CS-0247982;EN300-384092;8-(Trifluoromethyl)-2H-3,1-benzoxazine-2,4(1H)-dione;Z1094719200;8-(trifluoromethyl)-2,4-dihydro-1H-3,1-benzoxazine-2,4-dione

Chemical Property of 3-(Trifluoromethyl)isatoic anhydride

Chemical Property:

• PSA: 63.07000
• LogP: 1.50010
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 231.01432748
• Heavy Atom Count: 16
• Complexity: 329

Purity/Quality:

99% ^*data from raw suppliers

3-(Trifluoromethyl)isatoic anhydride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)C(F)(F)F)NC(=O)OC2=O