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Home > Pyridines > 1247139-79-2
1247139-79-2 | 2-(pyridin-4-yloxy)benzoic acid
CAS No: 1247139-79-2 Catalog No: AG01B88U MDL No:MFCD14696453
Product Description
Catalog Number:
AG01B88U
Chemical Name:
2-(pyridin-4-yloxy)benzoic acid
CAS Number:
1247139-79-2
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD14696453
IUPAC Name:
2-pyridin-4-yloxybenzoic acid
InChI:
InChI=1S/C12H9NO3/c14-12(15)10-3-1-2-4-11(10)16-9-5-7-13-8-6-9/h1-8H,(H,14,15)
InChI Key:
NDVHHTOLGZMAOK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1Oc1ccncc1
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:
2
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