Skip to the beginning of the images gallery

tert-butyl exo-7-amino-3-oxa-9-azabicyclo[3.3.1]nonane-9-carboxylate - 97%, high purity , CAS No.1820966-00-4

COA

Grade & Purity:

≥97%

Cas Number: 1820966-00-4
Molecular Weight: 242.31
MDL number: MFCD22415251
PubChem CID: 18507041

In stock

Item Number

T630691

Grouped product items
SKU	Size	Availability	Price
T630691-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$205.90
T630691-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$329.90
T630691-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$549.90
T630691-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$989.90

Basic Description

Synonyms	tert-butyl 7-amino-3-oxa-9-azabicyclo[3.3.1]nonane-9-carboxylate \| 1250991-27-5 \| 1820966-00-4 \| tert-Butyl exo-7-amino-3-oxa-9-azabicyclo[3.3.1]nonane-9-carboxylate \| ENDO-7-AMINO-9-BOC-3-OXA-9-AZA-BICYCLO[3.3.1]NONANE \| SCHEMBL15420956 \| VXC96600 \| MFCD
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Oxazinanes
    - Subclass Morpholines
      - Level5 Morpholine carboxylic acids and derivatives
        Level6 Morpholine carboxylic acids

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Oxazinanes
Subclass	Morpholines
Intermediate Tree Nodes	Morpholine carboxylic acids and derivatives
Direct Parent	Morpholine carboxylic acids
Alternative Parents	Piperidinecarboxylic acids Aminopiperidines Carbamate esters Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Morpholine-4-carboxylic acid - Piperidinecarboxylic acid - 4-aminopiperidine - Piperidine - Carbamic acid ester - Dialkyl ether - Ether - Azacycle - Oxacycle - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Amine - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as morpholine carboxylic acids. These are heterocyclic compounds containing a morpholine ring substituted by one or more carboxylic acid groups.
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 7-amino-3-oxa-9-azabicyclo[3.3.1]nonane-9-carboxylate
INCHI	InChI=1S/C12H22N2O3/c1-12(2,3)17-11(15)14-9-4-8(13)5-10(14)7-16-6-9/h8-10H,4-7,13H2,1-3H3
InChIKey	PEAPNBGPRYMRNJ-UHFFFAOYSA-N
Smiles	CC(C)(C)OC(=O)N1C2CC(CC1COC2)N
Isomeric SMILES	CC(C)(C)OC(=O)N1C2CC(CC1COC2)N
PubChem CID	18507041
Molecular Weight	242.31

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	242.310 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	242.163 Da
Monoisotopic Mass	242.163 Da
Topological Polar Surface Area	64.800 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	287.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration