Cas no 54405-62-8 (3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester)
54405-62-8 structure
Product Name:3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester
CAS No:54405-62-8
MF:C7H10O4
MW:158.151902675629
CID:354684
PubChem ID:11469210
Update Time:2025-04-19
3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester
- methyl 2-(2-oxooxolan-3-yl)acetate
- DTXSID40466803
- 54405-62-8
-
- Inchi： 1S/C7H10O4/c1-10-6(8)4-5-2-3-11-7(5)9/h5H,2-4H2,1H3
- InChI Key： ULOWAAFIHMAPLX-UHFFFAOYSA-N
- SMILES： O1C(C(CC(=O)OC)CC1)=O
Computed Properties
- Exact Mass: 158.0579
- Monoisotopic Mass: 158.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 175
- 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
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester Related Literature
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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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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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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5. 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
54405-62-8 (3-Furanacetic acid, tetrahydro-2-oxo-, methyl ester) Related Products
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