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tert-butyl (3R,4S)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate - 97%, high purity , CAS No.1290191-69-3

COA

Grade & Purity:

≥97%

Cas Number: 1290191-69-3
Molecular Weight: 230.31
PubChem CID: 53827692

In stock

Item Number

T628117

Grouped product items
SKU	Size	Availability	Price
T628117-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$382.90
T628117-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$612.90
T628117-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,021.90
T628117-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,839.90

Basic Description

Synonyms	cis-1-Boc-4-aminomethyl-3-hydroxypiperidine \| 219985-15-6 \| 1290191-69-3 \| TERT-BUTYL (3R,4S)-4-(AMINOMETHYL)-3-HYDROXYPIPERIDINE-1-CARBOXYLATE \| cis-tert-Butyl 4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate \| SCHEMBL506083 \| MFCD18791264 \| MFCD2798923
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 Secondary alcohols Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Piperidinecarboxylic acid - Carbamic acid ester - Secondary alcohol - Azacycle - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - 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 (3R,4S)-4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate
INCHI	InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13-5-4-8(6-12)9(14)7-13/h8-9,14H,4-7,12H2,1-3H3/t8-,9-/m0/s1
InChIKey	GAGALXYDHSHHCD-IUCAKERBSA-N
Smiles	CC(C)(C)OC(=O)N1CCC(C(C1)O)CN
Isomeric SMILES	CC(C)(C)OC(=O)N1CC[C@H]([C@H](C1)O)CN
Molecular Weight	230.31
Reaxy-Rn	27391707
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27391707&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	230.300 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	230.163 Da
Monoisotopic Mass	230.163 Da
Topological Polar Surface Area	75.800 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	250.000
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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