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886851-55-4

886851-55-4 | 3-Pyridinecarboxylicacid, 6-[(tetrahydro-2H-pyran-4-yl)oxy]-

CAS No: 886851-55-4 Catalog No: AG0046VT MDL No:MFCD09258833

Product Description

Catalog Number:
AG0046VT
Chemical Name:
3-Pyridinecarboxylicacid, 6-[(tetrahydro-2H-pyran-4-yl)oxy]-
CAS Number:
886851-55-4
Molecular Formula:
C11H13NO4
Molecular Weight:
223.2252
MDL Number:
MFCD09258833
IUPAC Name:
6-(oxan-4-yloxy)pyridine-3-carboxylic acid
InChI:
InChI=1S/C11H13NO4/c13-11(14)8-1-2-10(12-7-8)16-9-3-5-15-6-4-9/h1-2,7,9H,3-6H2,(H,13,14)
InChI Key:
OLOSQIMMFCSJHD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(nc1)OC1CCOCC1

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.084g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.228g/mol
Monoisotopic Mass:
223.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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