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3-oxa-9-azabicyclo[3.3.1]nonan-7-one hydrochloride - 97%, high purity , CAS No.1126795-00-3

COA

Grade & Purity:

≥97%

Cas Number: 1126795-00-3
Molecular Weight: 177.63
PubChem CID: 71627138

In stock

Item Number

O172092

Grouped product items
SKU	Size	Availability	Price	Qty
O172092-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,102.90
O172092-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$8,405.90

Discover 3-oxa-9-azabicyclo[3.3.1]nonan-7-one hydrochloride by Aladdin Scientific in 97% for only $2,102.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-Oxa-9-azabicyclo[3.3.1]nonan-7-one hydrochloride \| 1126795-00-3 \| 3-Oxa-9-azabicyclo[3.3.1]nonan-7-one HCl \| MFCD20491410 \| 3-oxa-9-azabicyclo[3.3.1]nonan-7-one;hydrochloride \| SCHEMBL16237481 \| DTXSID50856514 \| WEAFOEKQEGQXCG-UHFFFAOYSA-N \| AKOS016846041 \| CS-W001299 \| PB
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Piperidines
    - Subclass Piperidinones

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Piperidinones
Intermediate Tree Nodes	Not available
Direct Parent	Piperidinones
Alternative Parents	Morpholines Cyclic ketones Oxacyclic compounds Dialkylamines Dialkyl ethers Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteropolycyclic compounds
Substituents	Piperidinone - Morpholine - Oxazinane - Ketone - Cyclic ketone - Dialkyl ether - Secondary aliphatic amine - Ether - Secondary amine - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Amine - Hydrochloride - Carbonyl group - Aliphatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as piperidinones. These are compounds containing a piperidine ring which bears a ketone.
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	3-oxa-9-azabicyclo[3.3.1]nonan-7-one;hydrochloride
INCHI	InChI=1S/C7H11NO2.ClH/c9-7-1-5-3-10-4-6(2-7)8-5;/h5-6,8H,1-4H2;1H
InChIKey	WEAFOEKQEGQXCG-UHFFFAOYSA-N
Smiles	C1C2COCC(N2)CC1=O.Cl
Isomeric SMILES	C1C2COCC(N2)CC1=O.Cl
Molecular Weight	177.63
Reaxy-Rn	15467705
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15467705&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	177.630 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	177.056 Da
Monoisotopic Mass	177.056 Da
Topological Polar Surface Area	38.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	144.000
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	2

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