Home Nitros 1-(2-fluoro-4-nitrophenyl)-3-methyl-1H-pyrazole

1-(2-fluoro-4-nitrophenyl)-3-methyl-1H-pyrazole

CAS No.:
1378754-34-7
Catalog Number:
AG01C3CG
Molecular Formula:
C10H8FN3O2
Molecular Weight:
221.1878
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Product Description
Catalog Number:
AG01C3CG
Chemical Name:
1-(2-fluoro-4-nitrophenyl)-3-methyl-1H-pyrazole
CAS Number:
1378754-34-7
Molecular Formula:
C10H8FN3O2
Molecular Weight:
221.1878
MDL Number:
MFCD20570520
IUPAC Name:
1-(2-fluoro-4-nitrophenyl)-3-methylpyrazole
InChI:
InChI=1S/C10H8FN3O2/c1-7-4-5-13(12-7)10-3-2-8(14(15)16)6-9(10)11/h2-6H,1H3
InChI Key:
XBOLYRIEQCSFJU-UHFFFAOYSA-N
SMILES:
Cc1ccn(n1)c1ccc(cc1F)[N+](=O)[O-]
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.06g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.191g/mol
Monoisotopic Mass:
221.06g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties