Cas no 61402-72-0 (Propanoic acid, 2-(1-oxopropoxy)-, methyl ester)
61402-72-0 structure
Product Name:Propanoic acid, 2-(1-oxopropoxy)-, methyl ester
CAS No:61402-72-0
MF:C7H12O4
MW:160.167782783508
CID:480732
PubChem ID:12294749
Update Time:2025-04-19
Propanoic acid, 2-(1-oxopropoxy)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-(1-oxopropoxy)-, methyl ester
- methyl 2-propanoyloxypropanoate
- DTXSID30485366
- 61402-72-0
- SCHEMBL4673030
-
- Inchi： 1S/C7H12O4/c1-4-6(8)11-5(2)7(9)10-3/h5H,4H2,1-3H3
- InChI Key： QCHIRICIDKIMSH-UHFFFAOYSA-N
- SMILES： O(C(CC)=O)C(C(=O)OC)C
Computed Properties
- Exact Mass: 160.07356
- Monoisotopic Mass: 160.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 153
- 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: 0.9
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
Propanoic acid, 2-(1-oxopropoxy)-, methyl ester Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
61402-72-0 (Propanoic acid, 2-(1-oxopropoxy)-, methyl ester) Related Products
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- 7492-70-8(Butanoic acid, 2-butoxy-1-methyl-2-oxoethyl ester)
- 37555-99-0(2-Ethoxy-malonic acid diethyl ester)
- 26780-50-7(Poly(D,L-lactide-co-glycolide), Resomer RG 858 S, Mw 190000-240000)
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- 3853-80-3((+/-)-2-ACETOXYPROPIONIC ACID)
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- 17639-76-8(Methyl 2-Methoxypropionate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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