Home Other Building Blocks 3-Bromo-4,5-difluorobenzoic acid

3-Bromo-4,5-difluorobenzoic acid

CAS No.:
1244642-73-6
Catalog Number:
AG000M1S
Molecular Formula:
C7H3BrF2O2
Molecular Weight:
236.9983
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$163
- +
10g
97%
In Stock USA
United States
$313
- +
25g
97%
In Stock USA
United States
$650
- +
Product Description
Catalog Number:
AG000M1S
Chemical Name:
3-Bromo-4,5-difluorobenzoic acid
CAS Number:
1244642-73-6
Molecular Formula:
C7H3BrF2O2
Molecular Weight:
236.9983
MDL Number:
MFCD20233291
IUPAC Name:
3-bromo-4,5-difluorobenzoic acid
InChI:
InChI=1S/C7H3BrF2O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12)
InChI Key:
PBUNICLVOHJWRN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)c(c(c1)Br)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:
235.928g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237g/mol
Monoisotopic Mass:
235.928g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties