Home Other Building Blocks 4-(2,4-difluorophenoxy)benzoic acid

4-(2,4-difluorophenoxy)benzoic acid

CAS No.:
748183-47-3
Catalog Number:
AG01AHOK
Molecular Formula:
C13H8F2O3
Molecular Weight:
250.1976
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Product Description
Catalog Number:
AG01AHOK
Chemical Name:
4-(2,4-difluorophenoxy)benzoic acid
CAS Number:
748183-47-3
Molecular Formula:
C13H8F2O3
Molecular Weight:
250.1976
MDL Number:
MFCD11529198
IUPAC Name:
4-(2,4-difluorophenoxy)benzoic acid
InChI:
InChI=1S/C13H8F2O3/c14-9-3-6-12(11(15)7-9)18-10-4-1-8(2-5-10)13(16)17/h1-7H,(H,16,17)
InChI Key:
GBNIIFZBFSZDQA-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)Oc1ccc(cc1)C(=O)O
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.044g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.201g/mol
Monoisotopic Mass:
250.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties