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Home > Pyridines > 183628-83-3
183628-83-3 | Pyridine, 1-acetyl-1,2,3,4-tetrahydrohydroxy-5-(2-piperidinyl)-, (R)- (9CI)
CAS No: 183628-83-3 Catalog No: AG0027S5 MDL No:
Product Description
Catalog Number:
AG0027S5
Chemical Name:
Pyridine, 1-acetyl-1,2,3,4-tetrahydrohydroxy-5-(2-piperidinyl)-, (R)- (9CI)
CAS Number:
183628-83-3
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
IUPAC Name:
1-[(2R)-2-hydroxy-5-piperidin-2-yl-3,4-dihydro-2H-pyridin-1-yl]ethanone
InChI:
InChI=1S/C12H20N2O2/c1-9(15)14-8-10(5-6-12(14)16)11-4-2-3-7-13-11/h8,11-13,16H,2-7H2,1H3/t11?,12-/m1/s1
InChI Key:
AOMTZAFUNKMPPE-PIJUOVFKSA-N
SMILES:
O[C@@H]1CCC(=CN1C(=O)C)C1CCCCN1
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
224.152g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
224.304g/mol
Monoisotopic Mass:
224.152g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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