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

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

CAS No.:
1261977-27-8
Catalog Number:
AG000SB2
Molecular Formula:
C14H9FO4
Molecular Weight:
260.2173
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$250
- +
5g
97%
In Stock USA
United States
$1000
- +
Product Description
Catalog Number:
AG000SB2
Chemical Name:
3-(5-Carboxy-2-fluorophenyl)benzoic acid
CAS Number:
1261977-27-8
Molecular Formula:
C14H9FO4
Molecular Weight:
260.2173
MDL Number:
MFCD18312666
IUPAC Name:
3-(3-carboxyphenyl)-4-fluorobenzoic acid
InChI:
InChI=1S/C14H9FO4/c15-12-5-4-10(14(18)19)7-11(12)8-2-1-3-9(6-8)13(16)17/h1-7H,(H,16,17)(H,18,19)
InChI Key:
IEJDNRSWYBPIET-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1c1cccc(c1)C(=O)O)C(=O)O
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.048g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
260.22g/mol
Monoisotopic Mass:
260.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties