Home Other Building Blocks 4,5-Difluorophthalic acid

4,5-Difluorophthalic acid

CAS No.:
18959-31-4
Catalog Number:
AG002DSE
Molecular Formula:
C8H4F2O4
Molecular Weight:
202.1118
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$148
- +
5g
95%
In Stock USA
United States
$350
- +
10g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG002DSE
Chemical Name:
4,5-Difluorophthalic acid
CAS Number:
18959-31-4
Molecular Formula:
C8H4F2O4
Molecular Weight:
202.1118
MDL Number:
MFCD00077514
IUPAC Name:
4,5-difluorophthalic acid
InChI:
InChI=1S/C8H4F2O4/c9-5-1-3(7(11)12)4(8(13)14)2-6(5)10/h1-2H,(H,11,12)(H,13,14)
InChI Key:
FFSBOABNRUJQFW-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)c(cc1C(=O)O)F
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.008g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
202.113g/mol
Monoisotopic Mass:
202.008g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties