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1260611-29-7 | 4-Piperidinol, 2-[(4-chlorophenyl)methyl]-, (2R,4R)-
CAS No: 1260611-29-7 Catalog No: AG000QWB MDL No:
Product Description
Catalog Number:
AG000QWB
Chemical Name:
4-Piperidinol, 2-[(4-chlorophenyl)methyl]-, (2R,4R)-
CAS Number:
1260611-29-7
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
IUPAC Name:
(2R,4R)-2-[(4-chlorophenyl)methyl]piperidin-4-ol
InChI:
InChI=1S/C12H16ClNO/c13-10-3-1-9(2-4-10)7-11-8-12(15)5-6-14-11/h1-4,11-12,14-15H,5-8H2/t11-,12-/m1/s1
InChI Key:
YJFDTCMKBVEWIM-VXGBXAGGSA-N
SMILES:
O[C@@H]1CCN[C@@H](C1)Cc1ccc(cc1)Cl
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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