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Home Halogens N-[4-bromo-3-(trifluoromethyl)phenyl]acetamide

N-[4-bromo-3-(trifluoromethyl)phenyl]acetamide

CAS No.:
41513-05-7
Catalog Number:
AG003KXK
Molecular Formula:
C9H7BrF3NO
Molecular Weight:
282.0572
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$82
- +
Product Description
Catalog Number:
AG003KXK
Chemical Name:
N-[4-bromo-3-(trifluoromethyl)phenyl]acetamide
CAS Number:
41513-05-7
Molecular Formula:
C9H7BrF3NO
Molecular Weight:
282.0572
MDL Number:
MFCD00052361
IUPAC Name:
N-[4-bromo-3-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C9H7BrF3NO/c1-5(15)14-6-2-3-8(10)7(4-6)9(11,12)13/h2-4H,1H3,(H,14,15)
InChI Key:
AOHSBSXIGFIMNC-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c(c1)C(F)(F)F)Br
EC Number:
609-933-3
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.966g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
282.06g/mol
Monoisotopic Mass:
280.966g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties