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136780-20-6 | 3-Pyrrolidinol, 1-[(2S)-2-piperidinylmethyl]-, (3S)-
CAS No: 136780-20-6 Catalog No: AG0012CP MDL No:
Product Description
Catalog Number:
AG0012CP
Chemical Name:
3-Pyrrolidinol, 1-[(2S)-2-piperidinylmethyl]-, (3S)-
CAS Number:
136780-20-6
Molecular Formula:
C10H20N2O
Molecular Weight:
184.2786
IUPAC Name:
(3S)-1-[[(2S)-piperidin-2-yl]methyl]pyrrolidin-3-ol
InChI:
InChI=1S/C10H20N2O/c13-10-4-6-12(8-10)7-9-3-1-2-5-11-9/h9-11,13H,1-8H2/t9-,10-/m0/s1
InChI Key:
AHKKARMWNUMUMD-UWVGGRQHSA-N
SMILES:
O[C@H]1CCN(C1)C[C@@H]1CCCCN1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
184.158g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.283g/mol
Monoisotopic Mass:
184.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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