Bis(2-methoxyethyl)amine - ≥98%(GC) , CAS No.111-95-5

CAS: 111-95-5 Cat. No.: B152060 Molecular Weight: 133.19 Beilstein Registry Number: 1736310 EC Number: 203-923-9

GRADE & PURITY ≥98%(GC)

Synonyms

Diethylamine, 2,2'-dimethoxy- | bis(2- methoxyethyl)amine | bis[2-(methyloxy)ethyl]amine | Bis(2-methoxyethyl)amine, 98% | 2-(methyloxy)-N-[2-(methyloxy)ethyl]ethanamine | BIDD:GT0278 | N,N-bis-(2-methoxy-ethyl)amine | N,N-bis(-2methoxyethyl)amine | N,N-b

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

Diethylamine, 2, 2'-dimethoxy- | bis(2- methoxyethyl)amine | bis[2-(methyloxy)ethyl]amine | Bis(2-methoxyethyl)amine, 98% | 2-(methyloxy)-N-[2-(methyloxy)ethyl]ethanamine | BIDD:GT0278 | N, N-bis-(2-methoxy-ethyl)amine | N, N-bis(-2methoxyethyl)amine | N, N-b

Specifications & Purity

≥98%(GC)

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥98%(GC)

Names and Identifiers

• Pubchem Sid: 488179701
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488179701
• Canonical Smiles: COCCNCCOC
• IUPAC Name: 2-methoxy-N-(2-methoxyethyl)ethanamine
• InChIKey: IBZKBSXREAQDTO-UHFFFAOYSA-N
• INCHI: 1S/C6H15NO2/c1-8-5-3-7-4-6-9-2/h7H,3-6H2,1-2H3
• Isomeric SMILES: COCCNCCOC
• WGK Germany: 3
• UN Number: 2734
• Packing Group: II
• Molecular Weight: 133.19
• Beilstein: 1736310
• Reaxy-Rn: 1736313
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1736313&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Secondary amines
          • Level6 Dialkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Secondary amines
• Direct Parent: Dialkylamines
• Alternative Parents: Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ether - Secondary aliphatic amine - Dialkyl ether - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as dialkylamines. These are organic compounds containing a dialkylamine group, characterized by two alkyl groups bonded to the amino nitrogen.
• 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

Chemical and Physical Properties

• Solubility: Solubility in water: Completely miscible
• Sensitivity: Air sensitive
• Refractive Index: 1.42
• Flash Point(°F): 136.4 °F
• Flash Point(°C): 58 °C
• Boil Point(°C): 172 °C
• Molecular Weight: 133.190 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 133.11 Da
• Monoisotopic Mass: 133.11 Da
• Topological Polar Surface Area: 30.500 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 44.300
• 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

References

1. Saisai Wang, Liqi Wan, Chunxiao Jin, Tao Wang, Kaixuan Zhuge, Yuxue Yue, Haiting Cai, Bolin Wang, Renqin Chang, Jia Zhao, Xiaonian Li.  (2023)  Mechanistic insight into acetylene hydrochlorination with Ru-ligands via dual activation promoted by metal-ligands cooperative catalysis.  APPLIED CATALYSIS A-GENERAL,      [PMID:] [10.1016/j.apcata.2023.119382]

2. Yiwen Qin, Pengfei Qi, Shuang Hao, Jun Xiao, Haoyu Zhang, Yunxia Hu.  (2024)  Impact of end groups of small molecules grafted to reverse osmosis membranes on their separation and antifouling performance.  DESALINATION,      [PMID:] [10.1016/j.desal.2024.117864]