Home Halogens 4-(5-chloropyridin-2-yl)-4-oxobutanoic acid

4-(5-chloropyridin-2-yl)-4-oxobutanoic acid

CAS No.:
1542589-72-9
Catalog Number:
AG01ACQK
Molecular Formula:
C9H8ClNO3
Molecular Weight:
213.6177
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ACQK
Chemical Name:
4-(5-chloropyridin-2-yl)-4-oxobutanoic acid
CAS Number:
1542589-72-9
Molecular Formula:
C9H8ClNO3
Molecular Weight:
213.6177
MDL Number:
MFCD23855584
IUPAC Name:
4-(5-chloropyridin-2-yl)-4-oxobutanoic acid
InChI:
InChI=1S/C9H8ClNO3/c10-6-1-2-7(11-5-6)8(12)3-4-9(13)14/h1-2,5H,3-4H2,(H,13,14)
InChI Key:
MVSPSHRIDIEPCF-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(=O)c1ccc(cn1)Cl
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.019g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.617g/mol
Monoisotopic Mass:
213.019g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties