Home Other Building Blocks 2-Bromo-4-trifluoromethoxythioanisole

2-Bromo-4-trifluoromethoxythioanisole

CAS No.:
951884-71-2
Catalog Number:
AG003GP1
Molecular Formula:
C8H6BrF3OS
Molecular Weight:
287.0968
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$75
- +
5g
97%
In Stock USA
United States
$225
- +
10g
97%
In Stock USA
United States
$350
- +
25g
97%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG003GP1
Chemical Name:
2-Bromo-4-trifluoromethoxythioanisole
CAS Number:
951884-71-2
Molecular Formula:
C8H6BrF3OS
Molecular Weight:
287.0968
MDL Number:
MFCD09801038
IUPAC Name:
2-bromo-1-methylsulfanyl-4-(trifluoromethoxy)benzene
InChI:
InChI=1S/C8H6BrF3OS/c1-14-7-3-2-5(4-6(7)9)13-8(10,11)12/h2-4H,1H3
InChI Key:
QCIMZFYEUFLMBB-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1Br)OC(F)(F)F
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.927g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.094g/mol
Monoisotopic Mass:
285.927g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties