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305839-54-7 | 2-Piperidinone, 3-iodo-1-(phenylmethyl)-
CAS No: 305839-54-7 Catalog No: AG0030M8 MDL No:
Product Description
Catalog Number:
AG0030M8
Chemical Name:
2-Piperidinone, 3-iodo-1-(phenylmethyl)-
CAS Number:
305839-54-7
Molecular Formula:
C12H14INO
Molecular Weight:
315.1501
IUPAC Name:
1-benzyl-3-iodopiperidin-2-one
InChI:
InChI=1S/C12H14INO/c13-11-7-4-8-14(12(11)15)9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2
InChI Key:
GHLHRLFHNZXNKO-UHFFFAOYSA-N
SMILES:
IC1CCCN(C1=O)Cc1ccccc1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.012g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.154g/mol
Monoisotopic Mass:
315.012g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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