Home Other Building Blocks 1-(5-BROMO-3-FLUORO-2-HYDROXYPHENYL)PROPAN-1-ONE

1-(5-BROMO-3-FLUORO-2-HYDROXYPHENYL)PROPAN-1-ONE

CAS No.:
1247452-17-0
Catalog Number:
AG01DV3G
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
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Product Description
Catalog Number:
AG01DV3G
Chemical Name:
1-(5-BROMO-3-FLUORO-2-HYDROXYPHENYL)PROPAN-1-ONE
CAS Number:
1247452-17-0
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
MDL Number:
MFCD16742899
IUPAC Name:
1-(5-bromo-3-fluoro-2-hydroxyphenyl)propan-1-one
InChI:
InChI=1S/C9H8BrFO2/c1-2-8(12)6-3-5(10)4-7(11)9(6)13/h3-4,13H,2H2,1H3
InChI Key:
XSUDZPZKGXGDJV-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cc(Br)cc(c1O)F
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.969g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.063g/mol
Monoisotopic Mass:
245.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties