Home Other Building Blocks 4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid

4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid

CAS No.:
1261978-52-2
Catalog Number:
AG000SAY
Molecular Formula:
C14H8F2O4
Molecular Weight:
278.2077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$300
- +
5g
96%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG000SAY
Chemical Name:
4-(3-Carboxy-5-fluorophenyl)-2-fluorobenzoic acid
CAS Number:
1261978-52-2
Molecular Formula:
C14H8F2O4
Molecular Weight:
278.2077
MDL Number:
MFCD18321471
IUPAC Name:
4-(3-carboxy-5-fluorophenyl)-2-fluorobenzoic acid
InChI:
InChI=1S/C14H8F2O4/c15-10-4-8(3-9(5-10)13(17)18)7-1-2-11(14(19)20)12(16)6-7/h1-6H,(H,17,18)(H,19,20)
InChI Key:
IGQUFUDCEOBZLV-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)c1ccc(c(c1)F)C(=O)O)C(=O)O
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.039g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
278.211g/mol
Monoisotopic Mass:
278.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties