Home Other Building Blocks 2-[4-(pyridin-2-yloxy)phenoxy]acetic acid

2-[4-(pyridin-2-yloxy)phenoxy]acetic acid

CAS No.:
949980-40-9
Catalog Number:
AG019L44
Molecular Formula:
C13H11NO4
Molecular Weight:
245.2307
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Product Description
Catalog Number:
AG019L44
Chemical Name:
2-[4-(pyridin-2-yloxy)phenoxy]acetic acid
CAS Number:
949980-40-9
Molecular Formula:
C13H11NO4
Molecular Weight:
245.2307
MDL Number:
MFCD09863292
IUPAC Name:
2-(4-pyridin-2-yloxyphenoxy)acetic acid
InChI:
InChI=1S/C13H11NO4/c15-13(16)9-17-10-4-6-11(7-5-10)18-12-3-1-2-8-14-12/h1-8H,9H2,(H,15,16)
InChI Key:
PRUVYXVNYCDREU-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1)Oc1ccccn1
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.069g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.234g/mol
Monoisotopic Mass:
245.069g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties