4-(4-Bromophenyl)-6-(trifluoromethyl)-2-pyrimidinylamine

Base Information

• Chemical Name: 4-(4-Bromophenyl)-6-(trifluoromethyl)-2-pyrimidinylamine
• CAS No.: 327098-68-0
• Molecular Formula: C11H7BrF3N3
• Molecular Weight: 318.09
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID50352465
• Wikidata: Q82129624
• ChEMBL ID: CHEMBL1324851
• Mol file: 327098-68-0.mol

Synonyms:327098-68-0;4-(4-Bromophenyl)-6-(trifluoromethyl)-2-pyrimidinylamine;4-(4-bromophenyl)-6-(trifluoromethyl)pyrimidin-2-amine;4-(4-bromophenyl)-6-(trifluoromethyl)-2-pyrimidinamine;4-(4-Bromo-phenyl)-6-trifluoromethyl-pyrimidin-2-ylamine;CDS1_000278;Maybridge1_002566;MLS000554972;DivK1c_001318;CHEMBL1324851;HMS548M14;DTXSID50352465;KJXMTKNZTBVNTC-UHFFFAOYSA-N;HMS2313I23;MFCD01312150;STK524468;AKOS000268219;CCG-244415;SMR000147089;CS-0367252;FT-0644424;A821382;J-513464

Chemical Property of 4-(4-Bromophenyl)-6-(trifluoromethyl)-2-pyrimidinylamine

Chemical Property:

• Vapor Pressure: 5.16E-08mmHg at 25°C
• Melting Point: 215-218°C
• Boiling Point: 442.1°C at 760 mmHg
• PKA: 0.93±0.10(Predicted)
• Flash Point: 221.2°C
• PSA: 51.80000
• Density: 1.646g/cm³
• LogP: 4.08830
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 316.97754
• Heavy Atom Count: 18
• Complexity: 279

Purity/Quality:

98%min ^*data from raw suppliers

4-(4-BROMOPHENYL)-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-AMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC(=NC(=N2)N)C(F)(F)F)Br