Home Other Building Blocks 2-Bromo-1-(3-fluorophenyl)ethan-1-one

2-Bromo-1-(3-fluorophenyl)ethan-1-one

CAS No.:
53631-18-8
Catalog Number:
AG003GMK
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$24
- +
5g
98%
In Stock USA
United States
$70
- +
10g
98%
In Stock USA
United States
$137
- +
25g
98%
In Stock USA
United States
$269
- +
100g
98%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG003GMK
Chemical Name:
2-Bromo-1-(3-fluorophenyl)ethan-1-one
CAS Number:
53631-18-8
Molecular Formula:
C8H6BrFO
Molecular Weight:
217.0350
MDL Number:
MFCD00109756
IUPAC Name:
2-bromo-1-(3-fluorophenyl)ethanone
InChI:
InChI=1S/C8H6BrFO/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4H,5H2
InChI Key:
ITAQNNGDCNFGID-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1cccc(c1)F
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.959g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.037g/mol
Monoisotopic Mass:
215.959g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Design, synthesis and biological evaluation of Trypanosoma brucei trypanothione synthetase inhibitors. ChemMedChem 20120102
Properties