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385425-15-0 | 2-Piperidinone, 1-(4-iodophenyl)-
CAS No: 385425-15-0 Catalog No: AG00I7NR MDL No:MFCD04037128
Product Description
Catalog Number:
AG00I7NR
Chemical Name:
2-Piperidinone, 1-(4-iodophenyl)-
CAS Number:
385425-15-0
Molecular Formula:
C11H12INO
Molecular Weight:
301.1235
MDL Number:
MFCD04037128
IUPAC Name:
1-(4-iodophenyl)piperidin-2-one
InChI:
InChI=1S/C11H12INO/c12-9-4-6-10(7-5-9)13-8-2-1-3-11(13)14/h4-7H,1-3,8H2
InChI Key:
OYDSTJMVOOOYDW-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)N1CCCCC1=O
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.996g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.127g/mol
Monoisotopic Mass:
300.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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