Home Halogens 4-(4-bromophenoxy)-3-fluorobenzoic acid

4-(4-bromophenoxy)-3-fluorobenzoic acid

CAS No.:
1020999-94-3
Catalog Number:
AG019WM8
Molecular Formula:
C13H8BrFO3
Molecular Weight:
311.1032
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Product Description
Catalog Number:
AG019WM8
Chemical Name:
4-(4-bromophenoxy)-3-fluorobenzoic acid
CAS Number:
1020999-94-3
Molecular Formula:
C13H8BrFO3
Molecular Weight:
311.1032
MDL Number:
MFCD11529204
IUPAC Name:
4-(4-bromophenoxy)-3-fluorobenzoic acid
InChI:
InChI=1S/C13H8BrFO3/c14-9-2-4-10(5-3-9)18-12-6-1-8(13(16)17)7-11(12)15/h1-7H,(H,16,17)
InChI Key:
VQKWHIRWRKGTBD-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)Oc1ccc(cc1F)C(=O)O
Properties
Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.964g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
311.106g/mol
Monoisotopic Mass:
309.964g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties