897375-66-5
2-(3-BROMO-PHENYL)-5-TERT-BUTYL-2H-PYRAZOL-3-YLAMINE HYDROCHLORIDE
Name2-(3-BROMO-PHENYL)-5-TERT-BUTYL-2H-PYRAZOL-3-YLAMINE HYDROCHLORIDE
FormulaC13 H16 Br N3 . Cl H
1Identification
【Name】
2-(3-BROMO-PHENYL)-5-TERT-BUTYL-2H-PYRAZOL-3-YLAMINE HYDROCHLORIDE
【CAS】
【MDL】
MFCD11506240
【English Synonyms】
【Formula】
C13 H16 Br N3 . Cl H
【MolWeight】
330.655
【Inchi】
InChI=1S/C13H16BrN3.ClH/c1-13(2,3)11-8-12(15)17(16-11)10-6-4-5-9(14)7-10;/h4-8H,15H2,1-3H3;1H
【InChIKey】
InChIKey=NYYKMGKZEMSTIM-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1cc(n(n1)c2cccc(c2)Br)N.Cl
【MOL File】
2-(3-BROMO-PHENYL)-5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(3-BROMO-PHENYL)-5-TERT-BUTYL-2H-PYRAZOL-3-YLAMINE HYDROCHLORIDE.cml