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2059943-98-3 | 1-(2-iodophenyl)-3-(2-methylpropanoyl)piperidin-2-one
CAS No: 2059943-98-3 Catalog No: AG01BZ0C MDL No:MFCD30487629
Product Description
Catalog Number:
AG01BZ0C
Chemical Name:
1-(2-iodophenyl)-3-(2-methylpropanoyl)piperidin-2-one
CAS Number:
2059943-98-3
Molecular Formula:
C15H18INO2
Molecular Weight:
371.2134
MDL Number:
MFCD30487629
IUPAC Name:
1-(2-iodophenyl)-3-(2-methylpropanoyl)piperidin-2-one
InChI:
InChI=1S/C15H18INO2/c1-10(2)14(18)11-6-5-9-17(15(11)19)13-8-4-3-7-12(13)16/h3-4,7-8,10-11H,5-6,9H2,1-2H3
InChI Key:
LPPFLMATAMSLJO-UHFFFAOYSA-N
SMILES:
O=C(C1CCCN(C1=O)c1ccccc1I)C(C)C
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.038g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
371.218g/mol
Monoisotopic Mass:
371.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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