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tert-butyl 3-(1H-imidazol-2-yl)piperidine-1-carboxylate - 97%, high purity , CAS No.1260672-41-0

COA

Grade & Purity:

≥97%

Cas Number: 1260672-41-0
Molecular Weight: 251.33
PubChem CID: 72213234

In stock

Item Number

T627924

Grouped product items
SKU	Size	Availability	Price
T627924-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$179.90
T627924-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$286.90
T627924-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$477.90
T627924-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$716.90
T627924-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,586.90

Basic Description

Synonyms	1260672-41-0 \| TERT-BUTYL 3-(1H-IMIDAZOL-2-YL)PIPERIDINE-1-CARBOXYLATE \| SCHEMBL15551483 \| MFCD18250314 \| AKOS023120605 \| AB72742 \| 1-Boc-3-(1H-imidazol-2-yl)piperidine \| AS-77793 \| CS-0048399 \| FT-0760960 \| P18891 \| t-Butyl 3-(1H-imidazol-2-yl)piperidine
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	Imidazolyl carboxylic acids and derivatives Heteroaromatic compounds Carbamate esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Piperidinecarboxylic acid - Imidazolyl carboxylic acid derivative - Heteroaromatic compound - Carbamic acid ester - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic 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 3-(1H-imidazol-2-yl)piperidine-1-carboxylate
INCHI	InChI=1S/C13H21N3O2/c1-13(2,3)18-12(17)16-8-4-5-10(9-16)11-14-6-7-15-11/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,15)
InChIKey	MNDQVEBOPUBTAA-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1CCCC(C1)C2=NC=CN2
Isomeric SMILES	CC(C)(C)OC(=O)N1CCCC(C1)C2=NC=CN2
PubChem CID	72213234
Molecular Weight	251.33

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	251.320 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	251.163 Da
Monoisotopic Mass	251.163 Da
Topological Polar Surface Area	58.200 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	301.000
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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