Cas no 7497-93-0 (Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester)
7497-93-0 structure
Product Name:Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester
CAS No:7497-93-0
MF:C11H18O6
MW:246.257024288177
CID:577982
PubChem ID:347933
Update Time:2025-04-19
Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester
- (1-ethoxy-1-oxopropan-2-yl) 2-acetyloxy-2-methylpropanoate
- AC1L88FN
- NSC406858
- DTXSID50324501
- 7497-93-0
- NSC-406858
-
- Inchi： 1S/C11H18O6/c1-6-15-9(13)7(2)16-10(14)11(4,5)17-8(3)12/h7H,6H2,1-5H3
- InChI Key： NUEZIELNRRTRFM-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C(C(=O)OC(C(=O)OCC)C)(C)C
Computed Properties
- Exact Mass: 246.11034
- Monoisotopic Mass: 246.11033829g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 307
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 78.9?2
Experimental Properties
- PSA: 78.9
- LogP: 0.82290
Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
7497-93-0 (Propanoic acid,2-(acetyloxy)-2-methyl-, 2-ethoxy-1-methyl-2-oxoethyl ester) Related Products
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