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1,4′-Bipiperidin-3-ol - Reagent Grade, high purity , CAS No.864356-11-6
Basic Description
Synonyms
DTXSID50610673 | AKOS006282535 | (rac)-[1,4']bipiperidinyl-3-ol | NNQUIJQEUBAMTA-UHFFFAOYSA-N | BB 0262923 | F13210 | FT-0762581 | 3-hydroxy-[1,4']bipiperidine | 1,4'-Bipiperidin-3-ol, AldrichCPR | 1-piperidin-4-ylpiperidin-3-ol | [1,4']Bipiperidinyl-3-ol
Specifications & Purity
Reagent grade
Legal Information
Product of ChemBridge Corp.
Grade
Reagent Grade
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Aminopiperidines
Intermediate Tree Nodes
Not available
Direct Parent
Aminopiperidines
Alternative Parents
Trialkylamines Secondary alcohols 1,2-aminoalcohols Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
4-aminopiperidine - 1,2-aminoalcohol - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Secondary aliphatic amine - Azacycle - Amine - Alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminopiperidines. These are compounds containing a piperidine that carries an amino group.
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
1-piperidin-4-ylpiperidin-3-ol
INCHI
InChI=1S/C10H20N2O/c13-10-2-1-7-12(8-10)9-3-5-11-6-4-9/h9-11,13H,1-8H2
InChIKey
NNQUIJQEUBAMTA-UHFFFAOYSA-N
Smiles
C1CC(CN(C1)C2CCNCC2)O
Isomeric SMILES
C1CC(CN(C1)C2CCNCC2)O
Molecular Weight
184.283
Reaxy-Rn
18786022
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18786022&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
184.280 g/mol
XLogP3
0.300
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
184.158 Da
Monoisotopic Mass
184.158 Da
Topological Polar Surface Area
35.500 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
157.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
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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