Home Other Building Blocks 2-(2-oxopyridin-1(2H)-yl)propanoic acid

2-(2-oxopyridin-1(2H)-yl)propanoic acid

CAS No.:
62031-77-0
Catalog Number:
AG01DIBZ
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG01DIBZ
Chemical Name:
2-(2-oxopyridin-1(2H)-yl)propanoic acid
CAS Number:
62031-77-0
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD09734670
IUPAC Name:
2-(2-oxopyridin-1-yl)propanoic acid
InChI:
InChI=1S/C8H9NO3/c1-6(8(11)12)9-5-3-2-4-7(9)10/h2-6H,1H3,(H,11,12)
InChI Key:
AMGZVLCLCSDDBR-UHFFFAOYSA-N
SMILES:
OC(=O)C(n1ccccc1=O)C
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties