Cas no 35449-34-4 (Acetic acid,2,2,2-trichloro-, 2-methoxyethyl ester)
35449-34-4 structure
Product Name:Acetic acid,2,2,2-trichloro-, 2-methoxyethyl ester
CAS No:35449-34-4
MF:C5H7Cl3O3
MW:221.466279268265
CID:314871
PubChem ID:244508
Update Time:2025-04-19
Acetic acid,2,2,2-trichloro-, 2-methoxyethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid,2,2,2-trichloro-, 2-methoxyethyl ester
- 2-methoxyethyl 2,2,2-trichloroacetate
- 2-methoxyethyl trichloroacetate
- AC1L6DUV
- AC1Q3GOK
- AG-K-67602
- AR-1E3215
- CTK4H4561
- NSC55429
- Trichlor-essigsaeure-(2-methoxy-aethylester)
- trichloro-acetic acid-(2-methoxy-ethyl ester)
- YWZKSIQICPCCBW-UHFFFAOYSA-N
- SCHEMBL11341812
- DTXSID00288361
- Trichloroacetic acid, 2-methoxyethyl ester
- NSC-55429
- 35449-34-4
- trichloro-acetic acid 2-methoxy-ethyl ester
-
- Inchi： 1S/C5H7Cl3O3/c1-10-2-3-11-4(9)5(6,7)8/h2-3H2,1H3
- InChI Key： YWZKSIQICPCCBW-UHFFFAOYSA-N
- SMILES： ClC(C(=O)OCCOC)(Cl)Cl
Computed Properties
- Exact Mass: 219.94621
- Monoisotopic Mass: 219.946
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 131
- 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: 1.9
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- Density: 1.3826
- Melting Point: 14.5°C
- Boiling Point: 317.55°C (rough estimate)
- Flash Point: 93.7°C
- Refractive Index: 1.4563 (estimate)
- PSA: 35.53
- LogP: 1.54620
Acetic acid,2,2,2-trichloro-, 2-methoxyethyl ester Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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