Home Other Building Blocks 5-(2-Cyanophenyl)-2-fluorobenzoic acid

5-(2-Cyanophenyl)-2-fluorobenzoic acid

CAS No.:
1345471-31-9
Catalog Number:
AG0070DG
Molecular Formula:
C14H8FNO2
Molecular Weight:
241.2172
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG0070DG
Chemical Name:
5-(2-Cyanophenyl)-2-fluorobenzoic acid
CAS Number:
1345471-31-9
Molecular Formula:
C14H8FNO2
Molecular Weight:
241.2172
MDL Number:
MFCD20441867
IUPAC Name:
5-(2-cyanophenyl)-2-fluorobenzoic acid
InChI:
InChI=1S/C14H8FNO2/c15-13-6-5-9(7-12(13)14(17)18)11-4-2-1-3-10(11)8-16/h1-7H,(H,17,18)
InChI Key:
ALXMYYDZKCKBFA-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1c1ccc(c(c1)C(=O)O)F
Properties
Complexity:
362  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.054g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.221g/mol
Monoisotopic Mass:
241.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties