Home Other Building Blocks 3-(3-Chlorophenyl)-5-fluorobenzoic acid

3-(3-Chlorophenyl)-5-fluorobenzoic acid

CAS No.:
1261929-09-2
Catalog Number:
AG000S6I
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG000S6I
Chemical Name:
3-(3-Chlorophenyl)-5-fluorobenzoic acid
CAS Number:
1261929-09-2
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
MDL Number:
MFCD18319905
IUPAC Name:
3-(3-chlorophenyl)-5-fluorobenzoic acid
InChI:
InChI=1S/C13H8ClFO2/c14-11-3-1-2-8(5-11)9-4-10(13(16)17)7-12(15)6-9/h1-7H,(H,16,17)
InChI Key:
IKIJGIQUYRAPGG-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)C(=O)O)c1cccc(c1)Cl
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.02g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.653g/mol
Monoisotopic Mass:
250.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties