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3-Carbethoxy-4-piperidone hydrochloride - 98%, high purity , CAS No.4644-61-5

COA

Grade & Purity:

≥98%

Cas Number: 4644-61-5
Molecular Weight: 207.65
MDL number: MFCD00043267
PubChem CID: 107315
PubChem SID: 488187404

In stock

Item Number

C113897

Grouped product items
SKU	Size	Availability	Price
C113897-1g	1g	6	$9.90
C113897-5g	5g	3	$25.90
C113897-10g	10g	2	$39.90
C113897-25g	25g	2	$79.90
C113897-100g	100g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$239.90

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Chemical Biology (1255) Proline derivative (69)

Basic Description

Synonyms	ethyl 4-oxopiperidine-3-carboxylate hydrogen chloride \| 3-CARBETHOXY-4-PIPERIDONE HCl \| EINECS 225-073-8 \| FT-0604465 \| InChI=1/C7H8O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H \| SCHEMBL443973 \| AMY12129 \| EN300-260645 \| NSC74467 \| NSC-74467 \| PB25923 \| RTYXWL
Specifications & Purity	≥98%
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	Piperidinones 1,3-dicarbonyl compounds Cyclic ketones Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Piperidinecarboxylic acid - Piperidinone - 1,3-dicarbonyl compound - Cyclic ketone - Ketone - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - 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

Pubchem Sid	488187404
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488187404
IUPAC Name	ethyl 4-oxopiperidine-3-carboxylate;hydrochloride
INCHI	InChI=1S/C8H13NO3.ClH/c1-2-12-8(11)6-5-9-4-3-7(6)10;/h6,9H,2-5H2,1H3;1H
InChIKey	RTYXWLMQWSFXNI-UHFFFAOYSA-N
Smiles	CCOC(=O)C1CNCCC1=O.Cl
Isomeric SMILES	CCOC(=O)C1CNCCC1=O.Cl
Molecular Weight	207.65
Reaxy-Rn	3711279
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3711279&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
E2516273	Certificate of Analysis	Apr 26, 2025	C113897
E2516277	Certificate of Analysis	Apr 26, 2025	C113897
E2516278	Certificate of Analysis	Apr 26, 2025	C113897
I1229005	Certificate of Analysis	Jan 17, 2025	C113897
J2126531	Certificate of Analysis	Nov 01, 2021	C113897
K2321231	Certificate of Analysis	Nov 01, 2021	C113897

Chemical and Physical Properties

Solubility	Soluble in water
Sensitivity	Moisture sensitive
Melt Point(°C)	169-175°C
Molecular Weight	207.650 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	207.066 Da
Monoisotopic Mass	207.066 Da
Topological Polar Surface Area	55.400 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	191.000
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	2

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