Cas no 35752-46-6 (Acetic acid, phosphono-, 1-ethyl ester)
35752-46-6 structure
Product Name:Acetic acid, phosphono-, 1-ethyl ester
CAS No:35752-46-6
MF:C4H9O5P
MW:168.085022687912
CID:292533
PubChem ID:3614325
Update Time:2025-04-19
Acetic acid, phosphono-, 1-ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, phosphono-, 1-ethyl ester
- (2-ethoxy-2-oxoethyl)phosphonic acid
- ethyl 2-phosphonoacetate
- A841802
- AKOS006372196
- 35752-46-6
- DTXSID20394276
- ethyl phosphono-acetate
- FSJPQPQXDUGPFV-UHFFFAOYSA-N
- ethyl phosphonoacetate
- SCHEMBL435620
- (2-ethoxy-2-oxidanylidene-ethyl)phosphonic acid
-
- Inchi： 1S/C4H9O5P/c1-2-9-4(5)3-10(6,7)8/h2-3H2,1H3,(H2,6,7,8)
- InChI Key： FSJPQPQXDUGPFV-UHFFFAOYSA-N
- SMILES： P(CC(=O)OCC)(=O)(O)O
Computed Properties
- Exact Mass: 168.01877
- Monoisotopic Mass: 168.01876038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 159
- 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: -1.3
- Topological Polar Surface Area: 83.8?2
Experimental Properties
- PSA: 83.83
Acetic acid, phosphono-, 1-ethyl ester Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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