Home Halogens 2-bromo-1-(3,4-difluoro-2-hydroxyphenyl)ethan-1-one

2-bromo-1-(3,4-difluoro-2-hydroxyphenyl)ethan-1-one

CAS No.:
1621375-69-6
Catalog Number:
AG01AF6Q
Molecular Formula:
C8H5BrF2O2
Molecular Weight:
251.0249
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Product Description
Catalog Number:
AG01AF6Q
Chemical Name:
2-bromo-1-(3,4-difluoro-2-hydroxyphenyl)ethan-1-one
CAS Number:
1621375-69-6
Molecular Formula:
C8H5BrF2O2
Molecular Weight:
251.0249
MDL Number:
MFCD28789107
IUPAC Name:
2-bromo-1-(3,4-difluoro-2-hydroxyphenyl)ethanone
InChI:
InChI=1S/C8H5BrF2O2/c9-3-6(12)4-1-2-5(10)7(11)8(4)13/h1-2,13H,3H2
InChI Key:
HCRCQCWWMQRSKQ-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(c(c1O)F)F
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.944g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.027g/mol
Monoisotopic Mass:
249.944g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties