Home Other Building Blocks 1-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-5-one

1-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-5-one

CAS No.:
1244979-90-5
Catalog Number:
AG01BG0G
Molecular Formula:
C9H7FN2O
Molecular Weight:
178.1631
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Product Description
Catalog Number:
AG01BG0G
Chemical Name:
1-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-5-one
CAS Number:
1244979-90-5
Molecular Formula:
C9H7FN2O
Molecular Weight:
178.1631
MDL Number:
MFCD17189513
IUPAC Name:
2-(2-fluorophenyl)-4H-pyrazol-3-one
InChI:
InChI=1S/C9H7FN2O/c10-7-3-1-2-4-8(7)12-9(13)5-6-11-12/h1-4,6H,5H2
InChI Key:
WRWLZHMQBDBDLF-UHFFFAOYSA-N
SMILES:
O=C1CC=NN1c1ccccc1F
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.166g/mol
Monoisotopic Mass:
178.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties