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Bicyclo[3.3.1]nonan-9-one - 98%, high purity , CAS No.17931-55-4

COA

Grade & Purity:

≥98%

Cas Number: 17931-55-4
Molecular Weight: 138.21
PubChem CID: 86638

In stock

Item Number

B168006

Grouped product items
SKU	Size	Availability	Price	Qty
B168006-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$239.90

Discover Bicyclo[3.3.1]nonan-9-one by Aladdin Scientific in 98% for only $239.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	SCHEMBL15165842 \| SCHEMBL544303 \| EN300-90377 \| Bicyclo(3.3.1)nonan-9-one \| Bicyclo[3.3.1]nonan-9-one \| Bicyclo[3.3.1]nona-9-one \| FT-0711708 \| DTXSID00939200 \| AKOS023413743 \| Bicyclo[3.3.1]nonan-9-one, >=98% \| bicyclo [3.3.1] nonan-9-one \| NSC 125346 \|
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Not available
Direct Parent	Ketones
Alternative Parents	Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.
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	bicyclo[3.3.1]nonan-9-one
INCHI	InChI=1S/C9H14O/c10-9-7-3-1-4-8(9)6-2-5-7/h7-8H,1-6H2
InChIKey	SKTMMSQPXGWCAP-UHFFFAOYSA-N
Smiles	C1CC2CCCC(C1)C2=O
Isomeric SMILES	C1CC2CCCC(C1)C2=O
WGK Germany	3
Molecular Weight	138.21
Reaxy-Rn	2041243
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2041243&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	138.210 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	138.104 Da
Monoisotopic Mass	138.104 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	127.000
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	1

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