Home Halogens (3-bromophenyl)difluoroacetic acid

(3-bromophenyl)difluoroacetic acid

CAS No.:
885068-76-8
Catalog Number:
AG019T9W
Molecular Formula:
C8H5BrF2O2
Molecular Weight:
251.0249
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$387
- +
1g
95%
1 week
United States
$910
- +
Product Description
Catalog Number:
AG019T9W
Chemical Name:
(3-bromophenyl)difluoroacetic acid
CAS Number:
885068-76-8
Molecular Formula:
C8H5BrF2O2
Molecular Weight:
251.0249
MDL Number:
MFCD11167799
IUPAC Name:
2-(3-bromophenyl)-2,2-difluoroacetic acid
InChI:
InChI=1S/C8H5BrF2O2/c9-6-3-1-2-5(4-6)8(10,11)7(12)13/h1-4H,(H,12,13)
InChI Key:
CYIBFFJUPHCMOO-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(C(=O)O)(F)F
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.944g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.027g/mol
Monoisotopic Mass:
249.944g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties