Home Carboxys 3-phenoxypyridine-4-carboxylic acid

3-phenoxypyridine-4-carboxylic acid

CAS No.:
54629-99-1
Catalog Number:
AG01B8B3
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
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Product Description
Catalog Number:
AG01B8B3
Chemical Name:
3-phenoxypyridine-4-carboxylic acid
CAS Number:
54629-99-1
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD24160363
IUPAC Name:
3-phenoxypyridine-4-carboxylic acid
InChI:
InChI=1S/C12H9NO3/c14-12(15)10-6-7-13-8-11(10)16-9-4-2-1-3-5-9/h1-8H,(H,14,15)
InChI Key:
FDQFTGXHOIXOCY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccncc1Oc1ccccc1
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.058g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.208g/mol
Monoisotopic Mass:
215.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties