Home Halogens 4-bromophenyl 2,2,2-trifluoroacetate

4-bromophenyl 2,2,2-trifluoroacetate

CAS No.:
5672-84-4
Catalog Number:
AG00Q72K
Molecular Formula:
C8H4BrF3O2
Molecular Weight:
269.0154
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
99%
1 week
United States
$191
- +
5g
99%
1 week
United States
$496
- +
Product Description
Catalog Number:
AG00Q72K
Chemical Name:
4-bromophenyl 2,2,2-trifluoroacetate
CAS Number:
5672-84-4
Molecular Formula:
C8H4BrF3O2
Molecular Weight:
269.0154
MDL Number:
MFCD01754394
IUPAC Name:
(4-bromophenyl) 2,2,2-trifluoroacetate
InChI:
InChI=1S/C8H4BrF3O2/c9-5-1-3-6(4-2-5)14-7(13)8(10,11)12/h1-4H
InChI Key:
WNDACGMBVBWZGO-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)Oc1ccc(cc1)Br
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.935g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.017g/mol
Monoisotopic Mass:
267.935g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties