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113684-50-7 | 4-Piperidinone, 1-hydroxy-
CAS No: 113684-50-7 Catalog No: AG0009AO MDL No:
Product Description
Catalog Number:
AG0009AO
Chemical Name:
4-Piperidinone, 1-hydroxy-
CAS Number:
113684-50-7
Molecular Formula:
C5H9NO2
Molecular Weight:
115.1305
IUPAC Name:
1-hydroxypiperidin-4-one
InChI:
InChI=1S/C5H9NO2/c7-5-1-3-6(8)4-2-5/h8H,1-4H2
InChI Key:
RBSFFHQWOUNEJJ-UHFFFAOYSA-N
SMILES:
ON1CCC(=O)CC1
Properties
Complexity:
92.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.063g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
115.132g/mol
Monoisotopic Mass:
115.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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