Home Other Building Blocks 2-(3-Chloro-5-fluorophenyl)benzoic acid

2-(3-Chloro-5-fluorophenyl)benzoic acid

CAS No.:
1261915-22-3
Catalog Number:
AG000S65
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
10g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG000S65
Chemical Name:
2-(3-Chloro-5-fluorophenyl)benzoic acid
CAS Number:
1261915-22-3
Molecular Formula:
C13H8ClFO2
Molecular Weight:
250.6528
MDL Number:
MFCD18312643
IUPAC Name:
2-(3-chloro-5-fluorophenyl)benzoic acid
InChI:
InChI=1S/C13H8ClFO2/c14-9-5-8(6-10(15)7-9)11-3-1-2-4-12(11)13(16)17/h1-7H,(H,16,17)
InChI Key:
SYXWEQNEFAOHCG-UHFFFAOYSA-N
SMILES:
Fc1cc(Cl)cc(c1)c1ccccc1C(=O)O
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:
3.6  
Properties