Home Other Building Blocks 3-[(4-FLUOROPHENYL)-5-(2-BROMOACETYL)]ISOXAZOLE

3-[(4-FLUOROPHENYL)-5-(2-BROMOACETYL)]ISOXAZOLE

CAS No.:
888723-43-1
Catalog Number:
AG01E2MI
Molecular Formula:
C11H7BrFNO2
Molecular Weight:
284.0812
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Product Description
Catalog Number:
AG01E2MI
Chemical Name:
3-[(4-FLUOROPHENYL)-5-(2-BROMOACETYL)]ISOXAZOLE
CAS Number:
888723-43-1
Molecular Formula:
C11H7BrFNO2
Molecular Weight:
284.0812
MDL Number:
MFCD08443811
IUPAC Name:
2-bromo-1-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]ethanone
InChI:
InChI=1S/C11H7BrFNO2/c12-6-10(15)11-5-9(14-16-11)7-1-3-8(13)4-2-7/h1-5H,6H2
InChI Key:
MHGWOWJBQRRVJE-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1onc(c1)c1ccc(cc1)F
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.964g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.084g/mol
Monoisotopic Mass:
282.964g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties