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51362-40-4 | 6-phenoxy-pyridine-2-carboxylic acid
CAS No: 51362-40-4 Catalog No: AG00E1TF MDL No:MFCD14585023
Product Description
Catalog Number:
AG00E1TF
Chemical Name:
6-phenoxy-pyridine-2-carboxylic acid
CAS Number:
51362-40-4
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD14585023
IUPAC Name:
6-phenoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C12H9NO3/c14-12(15)10-7-4-8-11(13-10)16-9-5-2-1-3-6-9/h1-8H,(H,14,15)
InChI Key:
OHIOMWFFIKFFDX-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(n1)Oc1ccccc1
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:
2.6
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