1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine

Base Information

• Chemical Name: 1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine
• CAS No.: 58315-38-1
• Molecular Formula: C₁₁H₁₂F₃N₃O₂
• Molecular Weight: 275.23
• Hs Code.: 2933599090
• European Community (EC) Number: 671-961-7
• DSSTox Substance ID: DTXSID10377937
• Nikkaji Number: J267.373H
• Wikidata: Q82167335
• Mol file: 58315-38-1.mol

Synonyms:58315-38-1;1-[2-nitro-4-(trifluoromethyl)phenyl]piperazine;N-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine;1-(2-Nitro-4-trifluoromethylphenyl)-piperazine;MFCD00052613;1-(2-Nitro-4-(trifluoromethyl)phenyl)piperazine;n-(2-nitro-4-(trifluoromethyl)phenyl)piperazine;3-Nitro-4-(piperazin-1-yl)benzotrifluoride;[2-nitro-4-(trifluoromethyl)phenyl]piperazine;1-(2-nitro-4-trifluoromethylphenyl)piperazine;1-(2-Nitro-4-trifluoromethyl-phenyl)-piperazine;SCHEMBL615409;DTXSID10377937;VHHZVCJGPKXDIC-UHFFFAOYSA-N;BBL002982;STK013417;AKOS000288825;PS-6716;(4-trifluromethyl-2-nitrophenyl)piperazine;BB 0245822;EU-0004535;FT-0607101;EN300-40661;AB00093269-01;1-(2-Nitro-4-trifluoromethyl-phenyl)-piperazin e;A831827;SR-01000429637;J-504092;SR-01000429637-1

Chemical Property of 1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine

Chemical Property:

• Vapor Pressure: 1.14E-05mmHg at 25°C
• Melting Point: 65 °C
• Refractive Index: 1.515
• Boiling Point: 370 °C at 760 mmHg
• PKA: 8.58±0.10(Predicted)
• Flash Point: 177.6 °C
• PSA: 61.09000
• Density: 1.355 g/cm³
• LogP: 2.94020
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 275.08816112
• Heavy Atom Count: 19
• Complexity: 326

Purity/Quality:

98%min ^*data from raw suppliers

1-[2-Nitro-4-(trifluoromethyl)phenyl]piperazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]