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2,4-Dioxopiperidine-1-carboxylic acid tert-butyl ester - 98%, high purity , CAS No.845267-78-9

COA

Grade & Purity:

≥98%

Cas Number: 845267-78-9
Molecular Weight: 213.24
MDL number: MFCD10566071
PubChem CID: 23730999
PubChem SID: 488200604

In stock

Item Number

D479547

Grouped product items
SKU	Size	Availability	Price
D479547-1g	1g	3	$9.90
D479547-5g	5g	3	$35.90
D479547-25g	25g	4	$157.90
D479547-100g	100g	2	$568.90

Basic Description

Synonyms	BBL101382 \| STL555178 \| A840833 \| CAS-111-65-9 \| 1-Boc-2, 4-piperidinedione \| 2,4-Dioxopiperidine-1-carboxylic acid tert-butyl ester, AldrichCPR \| MFCD10566071 \| Cresol,m- \| FT-0647286 \| PB14806 \| Tert-Butyl 2,4-dioxopiperidine-1-carboxylate \| tert-Butyl
Specifications & Purity	≥98%
Legal Information	Product of Synthonix

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	Piperidinediones Delta lactams 1,3-dicarbonyl compounds Dicarboximides Carbamate esters Cyclic ketones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Piperidinecarboxylic acid - Piperidinedione - Delta-lactam - Piperidinone - 1,3-dicarbonyl compound - Dicarboximide - Carbamic acid ester - Ketone - Lactam - Cyclic ketone - Azacycle - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - 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

Pubchem Sid	488200604
IUPAC Name	tert-butyl 2,4-dioxopiperidine-1-carboxylate
INCHI	InChI=1S/C10H15NO4/c1-10(2,3)15-9(14)11-5-4-7(12)6-8(11)13/h4-6H2,1-3H3
InChIKey	SLCAHLSQXDNQSF-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CCC(=O)CC1=O
Isomeric SMILES	CC(C)(C)OC(=O)N1CCC(=O)CC1=O
Molecular Weight	213.24
Reaxy-Rn	11292065
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11292065&ln=

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

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Analytical Chart:

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8 results found

Lot Number	Certificate Type	Date	Item
F2302156	Certificate of Analysis	May 11, 2023	D479547
F2301623	Certificate of Analysis	May 11, 2023	D479547
F2302155	Certificate of Analysis	May 11, 2023	D479547
F2301628	Certificate of Analysis	May 11, 2023	D479547
F2301624	Certificate of Analysis	May 11, 2023	D479547
F2302158	Certificate of Analysis	May 11, 2023	D479547
F2301627	Certificate of Analysis	May 11, 2023	D479547
F2302153	Certificate of Analysis	May 11, 2023	D479547

Chemical and Physical Properties

Molecular Weight	213.230 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	213.1 Da
Monoisotopic Mass	213.1 Da
Topological Polar Surface Area	63.700 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	303.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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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