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tert-butyl 3-hydroxy-4,4-dimethoxypiperidine-1-carboxylate - 97%, high purity
Discover tert-butyl 3-hydroxy-4,4-dimethoxypiperidine-1-carboxylate by Aladdin Scientific in 97% for only $210.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
TERT-BUTYL 3-HYDROXY-4,4-DIMETHOXYPIPERIDINE-1-CARBOXYLATE | 841286-80-4 | MFCD22493470 | 1-piperidinecarboxylic acid, 3-hydroxy-4,4-dimethoxy-, 1,1-dimethylethyl ester | SCHEMBL2726581 | DTXSID90465508 | NJRYBJQLRONERE-UHFFFAOYSA-N | AMY34267 | 1-Boc-4,4-dimethoxypiperi
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Piperidinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Piperidinecarboxylic acids
Alternative Parents
Ketals Carbamate esters Secondary alcohols Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Piperidinecarboxylic acid - Ketal - Carbamic acid ester - Secondary alcohol - Azacycle - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - Organopnictogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperidinecarboxylic acids. These are compounds containing a piperidine ring which bears a carboxylic acid 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
tert-butyl 3-hydroxy-4,4-dimethoxypiperidine-1-carboxylate
INCHI
InChI=1S/C12H23NO5/c1-11(2,3)18-10(15)13-7-6-12(16-4,17-5)9(14)8-13/h9,14H,6-8H2,1-5H3
InChIKey
NJRYBJQLRONERE-UHFFFAOYSA-N
Smiles
CC(C)(C)OC(=O)N1CCC(C(C1)O)(OC)OC
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
261.310 g/mol
XLogP3
0.300
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
4
Exact Mass
261.158 Da
Monoisotopic Mass
261.158 Da
Topological Polar Surface Area
68.200 Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
295.000
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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