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1-[(tert-butoxy)carbonyl]-5-oxopiperidine-2-carboxylic acid - 97%, high purity , CAS No.1260641-46-0

COA

Grade & Purity:

≥97%

Cas Number: 1260641-46-0
Molecular Weight: 243.26
MDL number: MFCD15071871
PubChem CID: 66777370

In stock

Item Number

O635531

Grouped product items
SKU	Size	Availability	Price	Qty
O635531-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$219.90
O635531-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$524.90

Basic Description

Synonyms	1-(tert-Butoxycarbonyl)-5-oxopiperidine-2-carboxylic acid \| 1260641-46-0 \| 5-Oxo-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester \| 1-(BOC)-5-OXOPIPERIDINE-2-CARBOXYLIC ACID \| 1,2-Piperidinedicarboxylic acid, 5-oxo-, 1-(1,1-dimethylethyl) ester \| 1-[(2
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Alpha amino acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives
Direct Parent	Alpha amino acids and derivatives
Alternative Parents	Piperidinecarboxylic acids Piperidinones Carbamate esters Cyclic ketones Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Alpha-amino acid or derivatives - Piperidinecarboxylic acid - Piperidinone - Piperidine - Carbamic acid ester - Ketone - Cyclic ketone - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
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	1-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxopiperidine-2-carboxylic acid
INCHI	InChI=1S/C11H17NO5/c1-11(2,3)17-10(16)12-6-7(13)4-5-8(12)9(14)15/h8H,4-6H2,1-3H3,(H,14,15)
InChIKey	NYIZAJLUNOQXFW-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CC(=O)CCC1C(=O)O
Isomeric SMILES	CC(C)(C)OC(=O)N1CC(=O)CCC1C(=O)O
PubChem CID	66777370
Molecular Weight	243.26

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	243.260 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	243.111 Da
Monoisotopic Mass	243.111 Da
Topological Polar Surface Area	83.900 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	344.000
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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