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α-Homonojirimycin - >98.0%(HPLC), high purity
Basic Description
Synonyms
Hnj cpd | alpha-Homoallonojirimycin | AS-71348 | Homonojirimycin | Homo-nojirimycin | 2,6-bis(hydroxymethyl)piperidine-3,4,5-triol | BB 0220378 | alpha-Homonojirimycin, >=98.0% (TLC) | BDBM50259956 | BDBM50403720 | (2r,3r,5s,6r)-2,6-bis(hydroxymethyl)pipe
Specifications & Purity
≥98%(HPLC)
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Piperidines
Alternative Parents
Secondary alcohols 1,2-aminoalcohols Polyols Dialkylamines Azacyclic compounds Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Piperidine - 1,2-aminoalcohol - Secondary alcohol - Secondary aliphatic amine - Polyol - Secondary amine - Azacycle - Primary alcohol - Alcohol - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Amine - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
IUPAC Name
(2R,3S,5R,6R)-2,6-bis(hydroxymethyl)piperidine-3,4,5-triol
INCHI
InChI=1S/C7H15NO5/c9-1-3-5(11)7(13)6(12)4(2-10)8-3/h3-13H,1-2H2/t3-,4-,5-,6+,7?/m1/s1
InChIKey
CLVUFWXGNIFGNC-QTSLKERKSA-N
Smiles
C(C1C(C(C(C(N1)CO)O)O)O)O
Isomeric SMILES
C([C@@H]1[C@H](C([C@H]([C@H](N1)CO)O)O)O)O
Molecular Weight
193.2
Reaxy-Rn
24713573
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24713573&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
207°C(lit.)
Molecular Weight
193.200 g/mol
XLogP3
-2.400
Hydrogen Bond Donor Count
6
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
2
Exact Mass
193.095 Da
Monoisotopic Mass
193.095 Da
Topological Polar Surface Area
113.000 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
151.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
4
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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