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308579

Sigma-Aldrich

5,6-Benzo-4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacos-5-ene solution

5,6-Benzo-4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacos-5-ene solution
1 of 1 reviewers received a sample product or took part in a promotion

50 wt. % in toluene

Synonym(s):

Kryptofix® 222B, Kryptand 222B

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100 MG
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100 MG
€80.30

About This Item

Empirical Formula (Hill Notation):
C22H36N2O6
CAS Number:
Molecular Weight:
424.53
Beilstein:
586455
EC Number:
MDL number:
UNSPSC Code:
12352005
PubChem Substance ID:
NACRES:
NA.22

€80.30


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form

liquid

Quality Level

concentration

50 wt. % in toluene

refractive index

n20/D 1.516

density

0.995 g/mL at 25 °C

functional group

ether

SMILES string

C1COCCN2CCOCCOCCN(CCO1)CCOc3ccccc3OCC2

InChI

1S/C22H36N2O6/c1-2-4-22-21(3-1)29-15-9-23-5-11-25-17-19-27-13-7-24(10-16-30-22)8-14-28-20-18-26-12-6-23/h1-4H,5-20H2

InChI key

QXLUTPDNMOEWGG-UHFFFAOYSA-N

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Application

5,6-Benzo-4,7,13,16,21,24-hexaoxa-1,10-diazabicyclo[8.8.8]hexacos-5-ene can be used as a model ligand:
  • In the metal-ligand complex formation studies to predict ligand coordination with metal ions (Eu & Gd) using magnetic resonance imaging (MRI) technique.[1]
  • In the study of coordination environment as well as redox and electronic properties of its YbII complexes.[2]

Legal Information

Kryptofix is a registered trademark of Merck KGaA, Darmstadt, Germany

Signal Word

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Eye Irrit. 2 - Flam. Liq. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 2 - STOT SE 3

Target Organs

Central nervous system, Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

46.4 °F - closed cup

Flash Point(C)

8 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

EU REACH Annex XVII (Restriction List)

CAS No.

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Certificates of Analysis (COA)

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Spectroscopic and Electrochemical Trends in Divalent Lanthanides through Modulation of Coordination Environment
Jenks TC, et al.
Inorganic Chemistry, 59(4), 2613-2620 (2020)
Screening of ligands for redox-active europium using magnetic resonance imaging
Corbin BA, et al.
Bioorganic & Medicinal Chemistry, 26(19), 5274-5279 (2018)

Questions

Reviews

1 of 1 reviewers received a sample product or took part in a promotion

Active Filters

  1. Atlanta, GA
    • Review 1
    • Votes 3
    2 out of 5 stars.

    A bit disappointing

    I would not recommend this. I was under the impression I was receiving 100 mg of the title compound but I believe it is 100 mg of 50% w/w in toluene, so 50 mg. I was only able to recover <40 mg and some of the product in the ampoule was not toluene soluble. There is also no indication of its purity that I can find.

    Helpful?

    1. Response from MilliporeSigma:

      Thank you for taking the time to leave a review! We are sorry to hear that your experience did meet expectations. Our Technical Service team has reached out to you in effort to better understand and resolve this issue. We apologize for any inconvenience this may have caused.

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