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Cas no 945744-16-1 (Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate)
945744-16-1 structure
Product Name:Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate
CAS No:945744-16-1
MF:C7H13ClO4
MW:196.628721952438
CID:5035800
Update Time:2023-09-21
Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate
- Methyl 2-[2-(2-chloroethoxy)ethoxy]acetate (ACI)
-
- Inchi: 1S/C7H13ClO4/c1-10-7(9)6-12-5-4-11-3-2-8/h2-6H2,1H3
- InChI Key: LXNVRHJKDKWEFB-UHFFFAOYSA-N
- SMILES: O=C(COCCOCCCl)OC
Computed Properties
- Exact Mass: 196.0502366 g/mol
- Monoisotopic Mass: 196.0502366 g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 8
- Complexity: 118
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 44.8
- Molecular Weight: 196.63
Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Sodium hydride Solvents: Dimethylformamide ; 30 min, 0 °C
1.2 22.5 h, rt
1.2 22.5 h, rt
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: Oxalyl chloride ; 30 min, cooled; overnight, rt
Reference
- SNAP/CLIP-Tags and Strain-Promoted Azide-Alkyne Cycloaddition (SPAAC)/Inverse Electron Demand Diels-Alder (IEDDA) for Intracellular Orthogonal/Bioorthogonal LabelingMacias-Contreras, Miguel; He, Huan; Little, Kevin N.; Lee, Justin P.; Campbell, Ryan P.; et al, Bioconjugate Chemistry, 2020, 31(5), 1370-1381
Production Method 3
Reaction Conditions
1.1 Reagents: Oxalyl chloride Solvents: Methanol ; 30 min, 0 °C; 16 h, 0 °C
Reference
- Preparation of prenylated antibody-drug conjugates containing branched linkers useful for treating cancer, World Intellectual Property Organization, , ,
Production Method 4
Reaction Conditions
1.1 Reagents: Oxalyl chloride Solvents: Methanol ; 30 min, 0 °C; 16 h, 0 °C
Reference
- Preparation of prenylated antibody-drug conjugates containing peptide groups useful for treating cancer, World Intellectual Property Organization, , ,
Production Method 5
Reaction Conditions
1.1 Reagents: Oxalyl chloride Solvents: Methanol ; 30 min, 0 °C; 16 h, 0 °C
Reference
- Preparation of prenylated antibody-drug conjugates containing self-immolative groups useful for treating cancer, World Intellectual Property Organization, , ,
Production Method 6
Reaction Conditions
1.1 Reagents: Sodium hydride Solvents: Dimethylformamide ; 30 min, 0 °C
1.2 22.5 h, rt
1.2 22.5 h, rt
Reference
- Syntheses of sulfo-glycodendrimers using click chemistry and their biological evaluationMiura, Yoshiko; Onogi, Shunsuke; Fukuda, Tomohiro, Molecules, 2012, 17, 11877-11896
Production Method 7
Reaction Conditions
1.1 Reagents: Sodium methoxide Solvents: Methanol ; 20 min, rt
1.2 24 h, rt
1.2 24 h, rt
Reference
- Sugar balls: synthesis and supramolecular assembly of [60]fullereneKato, Haruhito; Boettcher, Christoph; Hirsch, Andreas, European Journal of Organic Chemistry, 2007, (16), 2659-2666
Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate Raw materials
Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate Preparation Products
Methyl 2-(2-(2-chloroethoxy)ethoxy)acetate Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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