945896-82-2
(6-CHLORO-PYRIMIDIN-4-YL)-(4-TRIFLUOROMETHYL-BENZYL)-AMINE
Name(6-CHLORO-PYRIMIDIN-4-YL)-(4-TRIFLUOROMETHYL-BENZYL)-AMINE
pro_formulaC12 H9 Cl F3 N3
1Identification
【Name】
(6-CHLORO-PYRIMIDIN-4-YL)-(4-TRIFLUOROMETHYL-BENZYL)-AMINE
【CAS】
【MDL】
MFCD09756975
【EnglishSynonyms】
【pro_formula】
C12 H9 Cl F3 N3
【pro_molWeight】
287.671
【Inchi】
InChI=1S/C12H9ClF3N3/c13-10-5-11(19-7-18-10)17-6-8-1-3-9(4-2-8)12(14,15)16/h1-5,7H,6H2,(H,17,18,19)
【InChIKey】
InChIKey=DHHBSMSFRGKYIF-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1CNc2cc(ncn2)Cl)C(F)(F)F
【MOL File】
(6-CHLORO-PYRIMIDIN-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:3
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
(6-CHLORO-PYRIMIDIN-4-YL)-(4-TRIFLUOROMETHYL-BENZYL)-AMINE.cml