Home Halogens methyl 2-(4-bromo-2-oxo-1,2-dihydropyridin-1-yl)acetate

methyl 2-(4-bromo-2-oxo-1,2-dihydropyridin-1-yl)acetate

CAS No.:
1629672-68-9
Catalog Number:
AG01BXVK
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
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Product Description
Catalog Number:
AG01BXVK
Chemical Name:
methyl 2-(4-bromo-2-oxo-1,2-dihydropyridin-1-yl)acetate
CAS Number:
1629672-68-9
Molecular Formula:
C8H8BrNO3
Molecular Weight:
246.0580
MDL Number:
MFCD22572383
IUPAC Name:
methyl 2-(4-bromo-2-oxopyridin-1-yl)acetate
InChI:
InChI=1S/C8H8BrNO3/c1-13-8(12)5-10-3-2-6(9)4-7(10)11/h2-4H,5H2,1H3
InChI Key:
LEGCGTQFNGFSMV-UHFFFAOYSA-N
SMILES:
COC(=O)Cn1ccc(cc1=O)Br
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.969g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.06g/mol
Monoisotopic Mass:
244.969g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties