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1956366-70-3 | 3-iodo-2,5,6-trimethylpyridin-4(1H)-one
CAS No: 1956366-70-3 Catalog No: AG01DU0D MDL No:MFCD30471876
Product Description
Catalog Number:
AG01DU0D
Chemical Name:
3-iodo-2,5,6-trimethylpyridin-4(1H)-one
CAS Number:
1956366-70-3
Molecular Formula:
C8H10INO
Molecular Weight:
263.0756
MDL Number:
MFCD30471876
IUPAC Name:
3-iodo-2,5,6-trimethyl-1H-pyridin-4-one
InChI:
InChI=1S/C8H10INO/c1-4-5(2)10-6(3)7(9)8(4)11/h1-3H3,(H,10,11)
InChI Key:
UGOHZDPLIOMDBJ-UHFFFAOYSA-N
SMILES:
Cc1[nH]c(C)c(c(=O)c1C)I
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.981g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.078g/mol
Monoisotopic Mass:
262.981g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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