Cas no 36584-85-7 (Propanoic acid, 2,2-dimethyl-, 2-methoxyethyl ester)
36584-85-7 structure
Product Name:Propanoic acid, 2,2-dimethyl-, 2-methoxyethyl ester
CAS No:36584-85-7
MF:C8H16O3
MW:160.210843086243
CID:292469
PubChem ID:11435103
Update Time:2025-04-19
Propanoic acid, 2,2-dimethyl-, 2-methoxyethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2,2-dimethyl-, 2-methoxyethyl ester
- 2-methoxyethyl 2,2-dimethylpropanoate
- SCHEMBL4156487
- 36584-85-7
- DTXSID30465704
-
- Inchi： 1S/C8H16O3/c1-8(2,3)7(9)11-6-5-10-4/h5-6H2,1-4H3
- InChI Key： BJQVGZMQTXMWMG-UHFFFAOYSA-N
- SMILES： O(CCOC)C(C(C)(C)C)=O
Computed Properties
- Exact Mass: 160.10998
- Monoisotopic Mass: 160.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 124
- 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: 1.4
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Propanoic acid, 2,2-dimethyl-, 2-methoxyethyl ester Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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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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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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