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Dibenzo-21-crown 7-Ether - 96%, high purity , CAS No.14098-41-0

COA

Grade & Purity:

≥96%

Cas Number: 14098-41-0
Molecular Weight: 404.45
MDL number: MFCD00068646
PubChem CID: 585932

In stock

Item Number

D302831

Grouped product items
SKU	Size	Availability	Price	Qty
D302831-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
D302831-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$133.90

View related series

Chelate / complex (112) Crown ether and azacrocodile ether (3) Material synthetic block (276)

Basic Description

Synonyms	DTXSID30342925 \| 2,5,8,15,18,21,24-heptaoxatricyclo[23.4.0.0^{9,14]nonacosa-1(29),9,11,13,25,27-hexaene \| J-007439 \| AB01099894-03 \| AKOS001025168 \| SY052448 \| Dibenzo[b,k][1,4,7,10,13,16,19]heptaoxacycloheneicosin, 6,7,9,10,12,13,20,21,23,24-decahydro- \|
Specifications & Purity	≥96%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Ethers
Intermediate Tree Nodes	Not available
Direct Parent	Alkyl aryl ethers
Alternative Parents	Benzenoids Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Alkyl aryl ether - Benzenoid - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl aryl ethers. These are organic compounds containing the alkyl aryl ether functional group with the generic formula R-O-R' , where R is an alkyl group and R' is an aryl 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	2,5,8,15,18,21,24-heptaoxatricyclo[23.4.0.09,14]nonacosa-1(29),9,11,13,25,27-hexaene
INCHI	InChI=1S/C22H28O7/c1-3-7-21-19(5-1)26-15-11-23-9-10-24-12-16-27-20-6-2-4-8-22(20)29-18-14-25-13-17-28-21/h1-8H,9-18H2
InChIKey	JKCQOMAQPUYHPL-UHFFFAOYSA-N
Smiles	C1COCCOC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCO1
Isomeric SMILES	C1COCCOC2=CC=CC=C2OCCOCCOC3=CC=CC=C3OCCO1
WGK Germany	3
Molecular Weight	404.45
Reaxy-Rn	1693830
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1693830&ln=

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

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

Analytical Chart:

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4 results found

Lot Number	Certificate Type	Date	Item
G2510433	Certificate of Analysis	Jun 30, 2025	D302831
G2510454	Certificate of Analysis	Jun 30, 2025	D302831
G2510434	Certificate of Analysis	Jun 30, 2025	D302831
G2510435	Certificate of Analysis	Jun 30, 2025	D302831

Chemical and Physical Properties

Melt Point(°C)	107 °C
Molecular Weight	404.500 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	0
Exact Mass	404.184 Da
Monoisotopic Mass	404.184 Da
Topological Polar Surface Area	64.599 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	373.000
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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