Home Other Building Blocks 2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]ethan-1-amine

2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]ethan-1-amine

CAS No.:
1354957-77-9
Catalog Number:
AG019S09
Molecular Formula:
C11H12FN3
Molecular Weight:
205.2315
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Product Description
Catalog Number:
AG019S09
Chemical Name:
2-[1-(4-fluorophenyl)-1H-pyrazol-3-yl]ethan-1-amine
CAS Number:
1354957-77-9
Molecular Formula:
C11H12FN3
Molecular Weight:
205.2315
MDL Number:
MFCD20501944
IUPAC Name:
2-[1-(4-fluorophenyl)pyrazol-3-yl]ethanamine
InChI:
InChI=1S/C11H12FN3/c12-9-1-3-11(4-2-9)15-8-6-10(14-15)5-7-13/h1-4,6,8H,5,7,13H2
InChI Key:
XTPXCQGSYYHOKN-UHFFFAOYSA-N
SMILES:
NCCc1ccn(n1)c1ccc(cc1)F
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.102g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.236g/mol
Monoisotopic Mass:
205.102g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties