Home Other Building Blocks 3-[4-(trifluoromethyl)-1H-pyrazol-1-yl]aniline

3-[4-(trifluoromethyl)-1H-pyrazol-1-yl]aniline

CAS No.:
1306605-68-4
Catalog Number:
AG01AIFE
Molecular Formula:
C10H8F3N3
Molecular Weight:
227.1858
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Product Description
Catalog Number:
AG01AIFE
Chemical Name:
3-[4-(trifluoromethyl)-1H-pyrazol-1-yl]aniline
CAS Number:
1306605-68-4
Molecular Formula:
C10H8F3N3
Molecular Weight:
227.1858
MDL Number:
MFCD18839046
IUPAC Name:
3-[4-(trifluoromethyl)pyrazol-1-yl]aniline
InChI:
InChI=1S/C10H8F3N3/c11-10(12,13)7-5-15-16(6-7)9-3-1-2-8(14)4-9/h1-6H,14H2
InChI Key:
ZJMUGLHQYNTZHF-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)n1ncc(c1)C(F)(F)F
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.19g/mol
Monoisotopic Mass:
227.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties