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Home Carboxys 3-[3-(carboxymethyl)phenyl]-5-fluorobenzoic acid

3-[3-(carboxymethyl)phenyl]-5-fluorobenzoic acid

CAS No.:
1393442-01-7
Catalog Number:
AG00HVJP
Molecular Formula:
C15H11FO4
Molecular Weight:
274.2438
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00HVJP
Chemical Name:
3-[3-(carboxymethyl)phenyl]-5-fluorobenzoic acid
CAS Number:
1393442-01-7
Molecular Formula:
C15H11FO4
Molecular Weight:
274.2438
MDL Number:
MFCD22383716
IUPAC Name:
3-[3-(carboxymethyl)phenyl]-5-fluorobenzoic acid
InChI:
InChI=1S/C15H11FO4/c16-13-7-11(6-12(8-13)15(19)20)10-3-1-2-9(4-10)5-14(17)18/h1-4,6-8H,5H2,(H,17,18)(H,19,20)
InChI Key:
MURVNYNUMZZRLO-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cccc(c1)c1cc(F)cc(c1)C(=O)O
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.064g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.247g/mol
Monoisotopic Mass:
274.064g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties