Home Halogens 2-(5-chloropyridin-2-yl)-2-oxoethyl acetate

2-(5-chloropyridin-2-yl)-2-oxoethyl acetate

CAS No.:
1797380-84-7
Catalog Number:
AG01B1LD
Molecular Formula:
C9H8ClNO3
Molecular Weight:
213.6177
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Product Description
Catalog Number:
AG01B1LD
Chemical Name:
2-(5-chloropyridin-2-yl)-2-oxoethyl acetate
CAS Number:
1797380-84-7
Molecular Formula:
C9H8ClNO3
Molecular Weight:
213.6177
MDL Number:
MFCD28012232
IUPAC Name:
[2-(5-chloropyridin-2-yl)-2-oxoethyl] acetate
InChI:
InChI=1S/C9H8ClNO3/c1-6(12)14-5-9(13)8-3-2-7(10)4-11-8/h2-4H,5H2,1H3
InChI Key:
NPKWFKKOYZOHGN-UHFFFAOYSA-N
SMILES:
CC(=O)OCC(=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:
0
Isotope Atom Count:
0
Molecular Weight:
213.617g/mol
Monoisotopic Mass:
213.019g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties