Home Other Building Blocks 3-[6-(tert-butoxy)pyridin-2-yl]propanoic acid

3-[6-(tert-butoxy)pyridin-2-yl]propanoic acid

CAS No.:
1384596-89-7
Catalog Number:
AG019ZOP
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
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Product Description
Catalog Number:
AG019ZOP
Chemical Name:
3-[6-(tert-butoxy)pyridin-2-yl]propanoic acid
CAS Number:
1384596-89-7
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
MDL Number:
MFCD22375282
IUPAC Name:
3-[6-[(2-methylpropan-2-yl)oxy]pyridin-2-yl]propanoic acid
InChI:
InChI=1S/C12H17NO3/c1-12(2,3)16-10-6-4-5-9(13-10)7-8-11(14)15/h4-6H,7-8H2,1-3H3,(H,14,15)
InChI Key:
JFFLRQXJXLZTIB-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1cccc(n1)OC(C)(C)C
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties