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1269291-39-5

1269291-39-5 | Pyrimidine, 2-[1-(2-fluorophenyl)-1H-pyrazol-5-yl]-

CAS No: 1269291-39-5 Catalog No: AG000TI1 MDL No:MFCD20275453

Product Description

Catalog Number:
AG000TI1
Chemical Name:
Pyrimidine, 2-[1-(2-fluorophenyl)-1H-pyrazol-5-yl]-
CAS Number:
1269291-39-5
Molecular Formula:
C13H9FN4
Molecular Weight:
240.2358
MDL Number:
MFCD20275453
IUPAC Name:
2-[2-(2-fluorophenyl)pyrazol-3-yl]pyrimidine
InChI:
InChI=1S/C13H9FN4/c14-10-4-1-2-5-11(10)18-12(6-9-17-18)13-15-7-3-8-16-13/h1-9H
InChI Key:
ZPKILXWCEZMCNS-UHFFFAOYSA-N
SMILES:
Fc1ccccc1n1nccc1c1ncccn1

Properties

Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.081g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.241g/mol
Monoisotopic Mass:
240.081g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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