Home Other Building Blocks 2-Bromo-3-(trifluoromethyl)benzoic acid

2-Bromo-3-(trifluoromethyl)benzoic acid

CAS No.:
177420-63-2
Catalog Number:
AG0025B7
Molecular Formula:
C8H4BrF3O2
Molecular Weight:
269.0154
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$294
- +
10g
96%
In Stock USA
United States
$525
- +
25g
96%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG0025B7
Chemical Name:
2-Bromo-3-(trifluoromethyl)benzoic acid
CAS Number:
177420-63-2
Molecular Formula:
C8H4BrF3O2
Molecular Weight:
269.0154
MDL Number:
MFCD08532493
IUPAC Name:
2-bromo-3-(trifluoromethyl)benzoic acid
InChI:
InChI=1S/C8H4BrF3O2/c9-6-4(7(13)14)2-1-3-5(6)8(10,11)12/h1-3H,(H,13,14)
InChI Key:
FIMDBAHLQCCYJK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1Br)C(F)(F)F
Properties
Complexity:
229  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
269.017g/mol
Monoisotopic Mass:
267.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties