Home Other Building Blocks (2R,3R,4R,5S)-1-Benzyl-2-(Hydroxymethyl)Piperidine-3,4,5-Triol

(2R,3R,4R,5S)-1-Benzyl-2-(Hydroxymethyl)Piperidine-3,4,5-Triol

CAS No.:
72458-46-9
Catalog Number:
AG01DHRC
Molecular Formula:
C13H19NO4
Molecular Weight:
253.2943
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Product Description
Catalog Number:
AG01DHRC
Chemical Name:
(2R,3R,4R,5S)-1-Benzyl-2-(Hydroxymethyl)Piperidine-3,4,5-Triol
CAS Number:
72458-46-9
Molecular Formula:
C13H19NO4
Molecular Weight:
253.2943
MDL Number:
MFCD30185871
IUPAC Name:
(2R,3R,4R,5S)-1-benzyl-2-(hydroxymethyl)piperidine-3,4,5-triol
InChI:
InChI=1S/C13H19NO4/c15-8-10-12(17)13(18)11(16)7-14(10)6-9-4-2-1-3-5-9/h1-5,10-13,15-18H,6-8H2/t10-,11+,12-,13-/m1/s1
InChI Key:
BTIIGIMBIARTEA-YVECIDJPSA-N
SMILES:
OC[C@H]1N(Cc2ccccc2)C[C@@H]([C@H]([C@@H]1O)O)O
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
253.131g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
253.298g/mol
Monoisotopic Mass:
253.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Literature
Title Journal
[Affect of deoxynojirimycin derivatives on hepatitis C virus morphogenesis]. Molekuliarnaia biologiia 20120101
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