Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

Basic Information

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CAS Number

16069-36-6

Molecular Formula

C20H36O6

Molecular Weight

372.5 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

47-53 ºC

Boiling Point

344°C

Refractive Index

1.4909

SMILES

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C1CCC2C(C1)OCCOCCOC3CCCCC3OCCOCCO2

InChI

InChI=1S/C20H36O6/c1-2-6-18-17(5-1)23-13-9-21-11-15-25-19-7-3-4-8-20(19)26-16-12-22-10-14-24-18/h17-20H,1-16H2

InChIKey

BBGKDYHZQOSNMU-UHFFFAOYSA-N

LogP

2.7220000000000004

Topological Polar Surface Area

55.38000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

300

Safety Information

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GHS Hazard Pictograms

H301

H311

H315

H319

H331

H335

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

H311 Toxic in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H331 Toxic if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1 Class 6.1

Sensitiveness

Hygroscopic

Synonyms & References

English

CCRIS 3612
Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine #
2,5,8,15,18,21-Hexaoxatricyclo(20.4.0.09,14)hexacosane
SY010002
Dicyclohexano-18-crown-6 ether
BRN 1130529
CS-W009764
Dibenzo[b,4,7,10,13,16-hexaoxacyclooctadecin, eicosahydro-
Dicyclohexano-18-crown-6,mixture of isomers
Crown ether dicyclohexyl-18-crown-6
2,3,11,12-Dicyclohexano-1,4,7-10,13,16-hexaoxacyclooctadecane
Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine
Dicyclohexano-18-crown-6, 98%
D78390
Dibenzo(b,k)-1,4,7,10,13,16-hexaoxacyclooctadecin, eicosahydro-
DTXSID30884870
NS00054310
2,5,8,15,18,21-Hexaoxatricyclo(20.4.0.0(sup 9,14))hexacosane
D2-06
Dicyclohexo-18-crown-6
Perhydrodibenzo[18]crown-6
cis-Dicyclohexano-18-crown-6
Dicyclohexano-18-crown 6-Ether
Dicyclohexyl 18-crown-6
Dibenzo(b,k)(1,4,7,10,13,16)hexaoxacyclooctadecin, eicosahydro-
2,8,15,18,21-Hexaoxatricyclo[20.4.0.09,14]hexacosane
Dibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin, eicosahydro-
BBGKDYHZQOSNMU-UHFFFAOYSA-
BB 0261748
2,5,8,15,18,21-Hexaoxatricyclo[20.4.0.09.14]hexacosane
Icosahydrodibenzo[b,k][1,4,7,10,13,16]-hexaoxacyclooctadecine

MDL Number

MFCD00005099

Customs Code

29329995

FAQ

What are the physical and chemical properties of Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6)?

Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6) is a crystalline compound with a high molecular weight, approximately 452.3 g/mol. It has low solubility in water and organic solvents, making it challenging to dissolve. It is highly reactive and forms stable complexes with certain metal ions. It crystallizes in the monoclinic system with a specific melting point around 330°C and a density of 1.2 g/cm³.

How is Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6) typically synthesized?

Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6) is synthesized through a series of complex organic reactions involving the condensation of two dibenzo compounds. Commonly, this involves a multistep process using Lewis acids as catalysts, with high selectivity towards the desired product. The overall yield is around 70-80% after purification.

What industries use Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6)?

Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6) finds applications in the pharmaceutical industry as a precursor for medicinal compounds. It is also used in the polymer industry for the development of novel materials with unique properties. Additionally, it is utilized in semiconductor technology for its electronic properties and in sensor technology for detection of specific analytes.

What precautions should be taken when handling Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6)?

Handling Icosahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine (CAS: 16069-36-6) requires strict adherence to safety guidelines. Protective equipment such as gloves, goggles, and lab coats should be worn. Work should be conducted in a well-ventilated fume hood. Emergency spill kits should be readily available. In case of exposure, seek immediate medical attention and refer to the SDS (Safety Data Sheet) for further guidance. This compound is reactive and may release toxic fumes if not handled properly.