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343373-22-8 | N-(5-iodopyridin-2-yl)-3-oxobutanamide
CAS No: 343373-22-8 Catalog No: AG00IYKB MDL No:MFCD01315228
Product Description
Catalog Number:
AG00IYKB
Chemical Name:
N-(5-iodopyridin-2-yl)-3-oxobutanamide
CAS Number:
343373-22-8
Molecular Formula:
C9H9IN2O2
Molecular Weight:
304.0844
MDL Number:
MFCD01315228
IUPAC Name:
N-(5-iodopyridin-2-yl)-3-oxobutanamide
InChI:
InChI=1S/C9H9IN2O2/c1-6(13)4-9(14)12-8-3-2-7(10)5-11-8/h2-3,5H,4H2,1H3,(H,11,12,14)
InChI Key:
OISXHXBBCDPNGR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cn1)I)CC(=O)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.971g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.087g/mol
Monoisotopic Mass:
303.971g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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