2-(Hydroxymethyl)-12-crown 4-Ether - ≥95%(GC) , CAS No.75507-26-5

CAS: 75507-26-5 Cat. No.: H157004 Formula: C₉H₁₈O₅ Peso molecolare: 206.24 Beilstein Registry Number: 4661970 Numero EC: 278-224-5

GRADE & PURITY ≥95%(GC)

Synonyms

2-(Hydroxymethyl)-1,2-crown 4-ether | (1,4,7,10-Tetraoxacyclododecan-2-yl)methanol | 1,4,7,10-Tetraoxacyclododecan-2-methanol | 1,4,7,10-tetraoxacyclododec-2-ylmethanol | NJIPEIQHUNDGPY-UHFFFAOYSA-N | 2-Hydroxymethyl-12-crown-4, 95% | 2-(Hydroxymethyl)-12

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Panoramica

2-Hydroxymethyl-12-crown-4 can be used: To prepare an ester of lasalocid with crown ether to study its complex formation with monovalent cations. To prepare hydrogel adsorbents for potential usage in the recovery of lithium-ions from seawater. As a starting material in the synthesis of metal-free phthalocyanines and metallophthalocyanines.

Specifications

Sinonimi

2-(Hydroxymethyl)-1,2-crown 4-ether | (1,4,7,10-Tetraoxacyclododecan-2-yl)methanol | 1,4,7,10-Tetraoxacyclododecan-2-methanol | 1,4,7,10-tetraoxacyclododec-2-ylmethanol | NJIPEIQHUNDGPY-UHFFFAOYSA-N | 2-Hydroxymethyl-12-crown-4, 95% | 2-(Hydroxymethyl)-12

Specifiche e purezza

≥95%(GC)

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature,Argon charged

Spedito in

Normal

Purezza

≥95%(GC)

Nomi e identificatori

• Pubchem Sid: 488192354
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192354
• Sorrisi canonici: C1COCCOC(COCCO1)CO
• IUPAC Name: 1,4,7,10-tetraoxacyclododec-2-ylmethanol
• InChIKey: NJIPEIQHUNDGPY-UHFFFAOYSA-N
• INCHI: 1S/C9H18O5/c10-7-9-8-13-4-3-11-1-2-12-5-6-14-9/h9-10H,1-8H2
• Isomeri SMILES: C1COCCOC(COCCO1)CO
• WGK Germania: 3
• Peso molecolare: 206.24
• Beilstein: 4661970
• Reaxy-Rn: 4661968
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4661968&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Oxacyclic compounds Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxacycle - Organoheterocyclic compound - Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: Not available

Data sources

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

Proprietà chimiche e fisiche

• Solubilità: Miscible in water. Soluble in non-polar solvents. Insoluble in water.
• Sensibilità: Light sensitive；air sensitive
• Indice di rifrazione: n20/D 1.480
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 115 °C/0.04 mmHg
• Peso molecolare: 206.240 g/mol
• XLogP3: -1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 206.115 Da
• Monoisotopic Mass: 206.115 Da
• Topological Polar Surface Area: 57.200 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 130.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Riferimenti

1. Weiwei Kang, Hong Zhao, Yan Cui, Xuguang Liu, Yongzhen Yang.  (2023)  Construction of novel stable surface ion-imprinted graphene aerogels for efficient and selective extraction of lithium ion.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2023.125946]

2. Weifeng Liu, Guang Yan, Erhui Zhang, Qi Liang, Lei Qin, Meiling Wang, Xuguang Liu, Yongzhen Yang.  (2020)  Extraction of lithium ions from acidic solution using electrochemically imprinted membrane.  DESALINATION,      [PMID:] [10.1016/j.desal.2020.114751]

3. Yan Cui, Wenrui Du, Hong Zhao, Weiwei Kang, Xuguang Liu, Yongzhen Yang.  (2024)  A novel recyclable surface ion-imprinted graphene aerogels for high selective adsorption of lithium in salt lake brine.  Surfaces and Interfaces,      [PMID:] [10.1016/j.surfin.2024.105574]