Home Other Building Blocks 1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-amine

1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-amine

CAS No.:
1153040-21-1
Catalog Number:
AG01AHUU
Molecular Formula:
C10H8F3N3
Molecular Weight:
227.1858
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Product Description
Catalog Number:
AG01AHUU
Chemical Name:
1-[3-(trifluoromethyl)phenyl]-1H-pyrazol-4-amine
CAS Number:
1153040-21-1
Molecular Formula:
C10H8F3N3
Molecular Weight:
227.1858
MDL Number:
MFCD12192655
IUPAC Name:
1-[3-(trifluoromethyl)phenyl]pyrazol-4-amine
InChI:
InChI=1S/C10H8F3N3/c11-10(12,13)7-2-1-3-9(4-7)16-6-8(14)5-15-16/h1-6H,14H2
InChI Key:
QYEHERJXNTXVNQ-UHFFFAOYSA-N
SMILES:
Nc1cnn(c1)c1cccc(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