Cas no 57026-64-9 (Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester)
57026-64-9 structure
Product Name:Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester
CAS No:57026-64-9
MF:C13H20O5
MW:256.294904708862
CID:346880
PubChem ID:371775
Update Time:2025-04-19
Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester
- ethyl 1-(3-ethoxy-3-oxopropyl)-2-oxocyclopentane-1-carboxylate
- ethyl 1-(3-ethoxy-3-oxo-propyl)-2-oxo-cyclopentanecarboxylate
- NSC-646219
- DTXSID70327332
- 57026-64-9
- CHEMBL2002678
- Ethyl 1-(3-ethoxy-3-oxopropyl)-2-oxocyclopentanecarboxylate
- NCI60_015951
- NSC646219
-
- Inchi： 1S/C13H20O5/c1-3-17-11(15)7-9-13(12(16)18-4-2)8-5-6-10(13)14/h3-9H2,1-2H3
- InChI Key： JROPNAGSHRQCNQ-UHFFFAOYSA-N
- SMILES： O=C1CCCC1(C(=O)OCC)CCC(=O)OCC
Computed Properties
- Exact Mass: 256.1311
- Monoisotopic Mass: 256.13107373g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 8
- Complexity: 336
- 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: 69.7?2
Experimental Properties
- PSA: 69.67
Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
57026-64-9 (Cyclopentanepropanoic acid, 1-(ethoxycarbonyl)-2-oxo-, ethyl ester) Related Products
- 517-23-7(2-Acetylbutyrolactone)
- 1540-29-0(Ethyl 2-acetylhexanoate)
- 774-05-0(ethyl 2-oxocycloheptane-1-carboxylate)
- 7152-15-0(Ethyl isobutyrylacetate)
- 1655-07-8(ethyl 2-oxocyclohexane-1-carboxylate)
- 607-97-6(Ethyl-2-ethylacetoacetate)
- 24922-00-7(Ethyl 3-cyclopentyl-3-oxopropanoate)
- 10472-24-9(methyl 2-oxocyclopentane-1-carboxylate)
- 609-14-3(ethyl 2-methyl-3-oxobutanoate)
- 611-10-9(ethyl 2-oxocyclopentane-1-carboxylate)
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