Home Halogens 1-Propanone, 2-bromo-1-[4-(trifluoromethyl)phenyl]-

1-Propanone, 2-bromo-1-[4-(trifluoromethyl)phenyl]-

CAS No.:
95728-57-7
Catalog Number:
AG005YCZ
Molecular Formula:
C10H8BrF3O
Molecular Weight:
281.0691
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Product Description
Catalog Number:
AG005YCZ
Chemical Name:
1-Propanone, 2-bromo-1-[4-(trifluoromethyl)phenyl]-
CAS Number:
95728-57-7
Molecular Formula:
C10H8BrF3O
Molecular Weight:
281.0691
MDL Number:
MFCD17010234
IUPAC Name:
2-bromo-1-[4-(trifluoromethyl)phenyl]propan-1-one
InChI:
InChI=1S/C10H8BrF3O/c1-6(11)9(15)7-2-4-8(5-3-7)10(12,13)14/h2-6H,1H3
InChI Key:
NFXCMWCJLDRJIM-UHFFFAOYSA-N
SMILES:
CC(C(=O)c1ccc(cc1)C(F)(F)F)Br
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.971g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.072g/mol
Monoisotopic Mass:
279.971g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties