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methyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate hydrochloride - 97%, high purity , CAS No.676371-65-6

COA

Grade & Purity:

≥97%

Cas Number: 676371-65-6
Molecular Weight: 177.63
PubChem CID: 72207322
PubChem SID: 488202314

In stock

Item Number

M177150

Grouped product items
SKU	Size	Availability	Price
M177150-100mg	100mg	3	$96.90
M177150-250mg	250mg	4	$200.90
M177150-1g	1g	1	$720.90

Discover methyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate hydrochloride by Aladdin Scientific in 97% for only $96.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	676371-65-6 \| METHYL 3-AMINOBICYCLO[1.1.1]PENTANE-1-CARBOXYLATE HYDROCHLORIDE \| Methyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate HCl \| 3-Amino-bicyclo[1.1.1]pentane-1-carboxylic acid methyl ester hydrochloride \| methyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate;
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Carboxylic acid derivatives
      - Level5 Carboxylic acid esters
        Level6 Methyl esters

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Carboxylic acid derivatives
Intermediate Tree Nodes	Carboxylic acid esters
Direct Parent	Methyl esters
Alternative Parents	Amino acids and derivatives Monocarboxylic acids and derivatives Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Methyl ester - Amino acid or derivatives - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl 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	488202314
IUPAC Name	methyl 3-aminobicyclo[1.1.1]pentane-1-carboxylate;hydrochloride
INCHI	InChI=1S/C7H11NO2.ClH/c1-10-5(9)6-2-7(8,3-6)4-6;/h2-4,8H2,1H3;1H
InChIKey	LCACMDQIVIBGNJ-UHFFFAOYSA-N
Smiles	COC(=O)C12CC(C1)(C2)N.Cl
Isomeric SMILES	COC(=O)C12CC(C1)(C2)N.Cl
Molecular Weight	177.63
Reaxy-Rn	9720566
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9720566&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
F2305405	Certificate of Analysis	Apr 24, 2023	M177150
F2305415	Certificate of Analysis	Apr 24, 2023	M177150
F2305403	Certificate of Analysis	Apr 24, 2023	M177150
F2305416	Certificate of Analysis	Apr 24, 2023	M177150
F2305404	Certificate of Analysis	Apr 24, 2023	M177150
F2305406	Certificate of Analysis	Apr 24, 2023	M177150

Chemical and Physical Properties

Molecular Weight	177.630 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	177.056 Da
Monoisotopic Mass	177.056 Da
Topological Polar Surface Area	52.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	180.000
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	2

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