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Home Other Building Blocks 1-methyl-4-[4-(trifluoromethyl)-1H-imidazol-2-yl]-1H-pyrazole

1-methyl-4-[4-(trifluoromethyl)-1H-imidazol-2-yl]-1H-pyrazole

CAS No.:
63874-98-6
Catalog Number:
AG01BDO5
Molecular Formula:
C8H7F3N4
Molecular Weight:
216.1632
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Product Description
Catalog Number:
AG01BDO5
Chemical Name:
1-methyl-4-[4-(trifluoromethyl)-1H-imidazol-2-yl]-1H-pyrazole
CAS Number:
63874-98-6
Molecular Formula:
C8H7F3N4
Molecular Weight:
216.1632
MDL Number:
MFCD24552150
IUPAC Name:
1-methyl-4-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyrazole
InChI:
InChI=1S/C8H7F3N4/c1-15-4-5(2-13-15)7-12-3-6(14-7)8(9,10)11/h2-4H,1H3,(H,12,14)
InChI Key:
ATDAAUBHZRNZNZ-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1)c1[nH]cc(n1)C(F)(F)F
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.062g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.167g/mol
Monoisotopic Mass:
216.062g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties