Home Halogens 3-chloro-4-[(3,4-difluorophenyl)methoxy]benzoic acid

3-chloro-4-[(3,4-difluorophenyl)methoxy]benzoic acid

CAS No.:
1355636-71-3
Catalog Number:
AG01B2IQ
Molecular Formula:
C14H9ClF2O3
Molecular Weight:
298.6693
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Product Description
Catalog Number:
AG01B2IQ
Chemical Name:
3-chloro-4-[(3,4-difluorophenyl)methoxy]benzoic acid
CAS Number:
1355636-71-3
Molecular Formula:
C14H9ClF2O3
Molecular Weight:
298.6693
MDL Number:
MFCD17169528
IUPAC Name:
3-chloro-4-[(3,4-difluorophenyl)methoxy]benzoic acid
InChI:
InChI=1S/C14H9ClF2O3/c15-10-6-9(14(18)19)2-4-13(10)20-7-8-1-3-11(16)12(17)5-8/h1-6H,7H2,(H,18,19)
InChI Key:
DKQBMLLBSPXXDM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)Cl)OCc1ccc(c(c1)F)F
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.021g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
298.67g/mol
Monoisotopic Mass:
298.021g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties