Home Halogens 1-[4-bromo-2-(trifluoromethyl)phenyl]propan-1-one

1-[4-bromo-2-(trifluoromethyl)phenyl]propan-1-one

CAS No.:
1251389-42-0
Catalog Number:
AG01BGRZ
Molecular Formula:
C10H8BrF3O
Molecular Weight:
281.0691
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Product Description
Catalog Number:
AG01BGRZ
Chemical Name:
1-[4-bromo-2-(trifluoromethyl)phenyl]propan-1-one
CAS Number:
1251389-42-0
Molecular Formula:
C10H8BrF3O
Molecular Weight:
281.0691
MDL Number:
MFCD16841977
IUPAC Name:
1-[4-bromo-2-(trifluoromethyl)phenyl]propan-1-one
InChI:
InChI=1S/C10H8BrF3O/c1-2-9(15)7-4-3-6(11)5-8(7)10(12,13)14/h3-5H,2H2,1H3
InChI Key:
BLRUIZCVHXIZAJ-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1C(F)(F)F)Br
Properties
Complexity:
239  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties