Home Other Building Blocks Methyl 3-oxo-3-(pyridin-2yl)propanoate

Methyl 3-oxo-3-(pyridin-2yl)propanoate

CAS No.:
1986455-23-5
Catalog Number:
AG019EXG
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$257
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Product Description
Catalog Number:
AG019EXG
Chemical Name:
Methyl 3-oxo-3-(pyridin-2yl)propanoate
CAS Number:
1986455-23-5
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD11849520
IUPAC Name:
methyl 3-oxo-3-(2H-pyridin-1-yl)propanoate
InChI:
InChI=1S/C9H11NO3/c1-13-9(12)7-8(11)10-5-3-2-4-6-10/h2-5H,6-7H2,1H3
InChI Key:
MMJVAKFTVVNTHR-UHFFFAOYSA-N
SMILES:
COC(=O)CC(=O)N1CC=CC=C1
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties