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tert-butyl (2S,4R)-4-hydroxy-2-methylpiperidine-1-carboxylate - 97%, high purity , CAS No.790667-91-3

COA

Grade & Purity:

≥97%

Cas Number: 790667-91-3
Molecular Weight: 215.29
MDL number: MFCD21607787
PubChem CID: 45097441

In stock

Item Number

T634550

Grouped product items
SKU	Size	Availability	Price
T634550-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$159.90
T634550-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$272.90
T634550-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,359.90
T634550-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,717.90

Basic Description

Synonyms	790667-91-3 \| tert-butyl (2S,4R)-4-hydroxy-2-methylpiperidine-1-carboxylate \| (2S,4R)-1-BOC-2-METHYL-4-HYDROXYPIPERIDINE \| (2S,4R)-tert-Butyl 4-hydroxy-2-methylpiperidine-1-carboxylate \| (trans)-tert-butyl 4-hydroxy-2-methylpiperidine-1-carboxylate \| tran
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Piperidines
    - Subclass Piperidinecarboxylic acids and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Piperidinecarboxylic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Piperidinecarboxylic acids
Alternative Parents	Carbamate esters Tertiary amines Secondary alcohols Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Piperidinecarboxylic acid - Carbamic acid ester - Tertiary amine - Secondary alcohol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Alcohol - 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
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. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tert-butyl (2S,4R)-4-hydroxy-2-methylpiperidine-1-carboxylate
INCHI	InChI=1S/C11H21NO3/c1-8-7-9(13)5-6-12(8)10(14)15-11(2,3)4/h8-9,13H,5-7H2,1-4H3/t8-,9+/m0/s1
InChIKey	RCXJVQLRZJXWNM-DTWKUNHWSA-N
Smiles	CC1CC(CCN1C(=O)OC(C)(C)C)O
Isomeric SMILES	C[C@H]1C[C@@H](CCN1C(=O)OC(C)(C)C)O
PubChem CID	45097441
Molecular Weight	215.29

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	215.290 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	215.152 Da
Monoisotopic Mass	215.152 Da
Topological Polar Surface Area	49.800 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	234.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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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