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128726-47-6 | 2-Piperidinone, 6-(hydroxymethyl)-, (6S)-
CAS No: 128726-47-6 Catalog No: AG000YCK MDL No:MFCD13181562
Product Description
Catalog Number:
AG000YCK
Chemical Name:
2-Piperidinone, 6-(hydroxymethyl)-, (6S)-
CAS Number:
128726-47-6
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
MDL Number:
MFCD13181562
IUPAC Name:
(6S)-6-(hydroxymethyl)piperidin-2-one
InChI:
InChI=1S/C6H11NO2/c8-4-5-2-1-3-6(9)7-5/h5,8H,1-4H2,(H,7,9)/t5-/m0/s1
InChI Key:
VMOQVTPKGUXWKA-YFKPBYRVSA-N
SMILES:
OC[C@@H]1CCCC(=O)N1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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