ChemicalBook >> CAS DataBase List >>1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE

CAS No.
33941-15-0
Chemical Name:
1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE
Synonyms
AZA-18-CROWN-6;1-AZA-18-CROWN-6;Aza-18-crown-6,98%;1-AZA-18-CROWN 6-ETHER;1-Aza-18-crown-6, ≥98%;1-Aza-18-crown 6-Ether >1-Aza-18-crown-6 >=98.0% (NT);PENTAOXA-16-AZACYCLOOCTADECANE;4,7,10,13,16-Pentaoxa-1-azacyclooctadecane;1-Aza-4,7,10,13,16-pentaoxacyclooctadecane
CBNumber:
CB8723167
Molecular Formula:
C12H25NO5
Molecular Weight:
263.33
MDL Number:
MFCD00075466
MOL File:
33941-15-0.mol
MSDS File:
SDS
Last updated:2026-01-13 11:26:32
Product description Number Pack Size Price
1-Aza-18-crown-6 ≥98.0% (NT) 11382 1g $429
1-Aza-18-crown-6 ≥98.0% (NT) 11382 5g $1830
1-Aza-18-crown 6-Ether >98.0%(GC) A1324 1g $276
1-Aza-18-crown 6-Ether >98.0%(GC) A1324 5g $1084
1,4,7,10,13-Pentaoxa-16-azacyclooctadecane P227453 50mg $60

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE Properties

Melting point 46-49 °C (lit.)
Boiling point 406.57°C (rough estimate)
Density 1.1122 (rough estimate)
refractive index 1.4287 (estimate)
Flash point >230 °F
storage temp. Keep in dark place,Inert atmosphere,Room temperature
pka 8.69±0.20(Predicted)
form powder to crystaline
color White to Light yellow to Light orange
Water Solubility Insoluble in water.
Sensitive Air Sensitive
BRN 1074079
InChI 1S/C12H25NO5/c1-3-14-5-7-16-9-11-18-12-10-17-8-6-15-4-2-13-1/h13H,1-12H2
InChIKey NBXKUSNBCPPKRA-UHFFFAOYSA-N
SMILES C1COCCOCCOCCOCCOCCN1
CAS DataBase Reference 33941-15-0(CAS DataBase Reference)
UNSPSC Code 12352005
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
3-10
HS Code  29349990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704
1
2 1

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE price More Price(25)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 11382 1-Aza-18-crown-6 ≥98.0% (NT) 33941-15-0 1g $429 2025-07-31 Buy
Sigma-Aldrich 11382 1-Aza-18-crown-6 ≥98.0% (NT) 33941-15-0 5g $1830 2025-07-31 Buy
TCI Chemical A1324 1-Aza-18-crown 6-Ether >98.0%(GC) 33941-15-0 1g $276 2025-07-31 Buy
TCI Chemical A1324 1-Aza-18-crown 6-Ether >98.0%(GC) 33941-15-0 5g $1084 2025-07-31 Buy
TRC P227453 1,4,7,10,13-Pentaoxa-16-azacyclooctadecane 33941-15-0 50mg $60 2021-12-16 Buy
Product number Packaging Price Buy
11382 1g $429 Buy
11382 5g $1830 Buy
A1324 1g $276 Buy
A1324 5g $1084 Buy
P227453 50mg $60 Buy

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE Chemical Properties,Uses,Production

Chemical Properties

white to light yellow crystals or crystalline mass

Uses

1-Aza-18-crown-6 is used as building block for the synthesis of bis-crown ethers, lariat ethers and other monofunctionalized macrocycles. It is also used as pharmaceutical intermediate.

Synthesis

Tetraethylene glycol di-p-tosylate

37860-51-8

Diethanolamine

111-42-2

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE

33941-15-0

To a 3L three-necked round-bottomed flask was sequentially added a magnetic stirrer, 1.50 L of tert-butanol (tBuOH) and potassium tert-butanol (KOtBu, 30.7 g, 274 mmol). The mixture was heated to 40 °C with continuous stirring for 30 min to ensure complete dissolution of KOtBu. Subsequently, tetraethylene glycol di-p-toluenesulfonate (46 g, 91.5 mmol, dissolved in 100 mL of dioxane) and diethanolamine (9.6 g, 91.3 mmol, dissolved in 100 mL of tBuOH), respectively, were slowly added dropwise to the reaction system over a period of 2 hours through two different dropping funnels. Note: The rate of titration has a significant effect on the reaction yield, and slow titration helps to increase the yield. After dropwise addition, the reaction mixture was continued to be stirred for 1 hour and subsequently cooled to room temperature. The reaction mixture was filtered through a Brinell funnel and the solvent was removed by rotary evaporator. To the residual brown viscous mass was added 100 mL of deionized water and extracted first with hexane (1 x 60 mL, discarding the hexane phase) and then with dichloromethane (CH2Cl2, 5 x 60 mL). The dichloromethane phases were combined, dried with anhydrous magnesium sulfate (MgSO4) and the solvent was again removed by rotary evaporator. The resulting dark brown residue was distilled under high vacuum through a ball-bulb distillation apparatus using a hot air gun for assisted heating, resulting in the colorless liquid-like product az-18-crown ether-6 (8.4 g, 35% yield). The nuclear magnetic resonance (NMR) spectrum of the product was consistent with the data reported in the literature. It was found that the tBuOH used in the reaction could be recovered by distillation and used in the subsequent synthesis of aza-crown ether even though it contained a small amount of dioxane (<5%).

References

[1] Bulletin of the Chemical Society of Japan, 1983, vol. 56, # 1, p. 212 - 218
[2] Polyhedron, 2018, vol. 141, p. 385 - 392
[3] Phosphorus, Sulfur and Silicon and the Related Elements, 2006, vol. 181, # 1, p. 219 - 225
[4] Journal of the Chemical Society, Chemical Communications, 1981, # 10, p. 471 - 472

112-60-7
33941-15-0
Synthesis of 1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE from tetraethylene glycol

1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE Suppliers

Global( 107)Suppliers
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Shaanxi Dideu Medichem Co. Ltd
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View Lastest Price from 1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
PENTAOXA-16-AZACYCLOOCTADECANE pictures 2024-08-15 PENTAOXA-16-AZACYCLOOCTADECANE
33941-15-0
US $1.00 / KG 1KG 99% 20T Shaanxi Dideu Medichem Co. Ltd
1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE pictures 2019-07-10 1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE
33941-15-0
US $3.00 / ASSAYS 1KG 99% 100kg Career Henan Chemical Co
1,4,7,10,13-PENTAOXA-16-AZACYCLOOCTADECANE 1-AZA-18-CROWN-6 1-AZA-18-CROWN 6-ETHER AZA-18-CROWN-6 1-Aza-4,7,10,13,16-pentaoxacyclooctadecane 4,7,10,13,16-Pentaoxa-1-azacyclooctadecane Aza-18-crown-6,98% 1-Aza-18-crown-6 >=98.0% (NT) 1-Aza-18-crown 6-Ether > 1-Aza-18-crown-6, ≥98% PENTAOXA-16-AZACYCLOOCTADECANE 33941-15-0 3941-15-0 33914-15-0 C12H25NO5 Chelation/Complexation Compounds Azacrown Ethers Macrocycles for Host-Guest Chemistry Crown Ethers Synthetic Reagents Azacrown Ethers Crown Ethers Functional Materials Macrocycles for Host-Guest Chemistry organic building block