Cas no 216519-84-5 (Propanoic acid, 2-(diphenoxyphosphinyl)-, ethyl ester)
216519-84-5 structure
Product Name:Propanoic acid, 2-(diphenoxyphosphinyl)-, ethyl ester
CAS No:216519-84-5
MF:C17H19O5P
MW:334.303526163101
CID:1403037
PubChem ID:10759122
Update Time:2025-04-20
Propanoic acid, 2-(diphenoxyphosphinyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-(diphenoxyphosphinyl)-, ethyl ester
- 216519-84-5
- Ethyl2-(diphenoxyphosphoryl)propanoate
- ETHYL DIPHENYL 2-PHOSPHONOPROPIONATE
- Ethyl 2-(diphenoxyphosphoryl)propanoate
- SC5149
- SCHEMBL24225368
-
- Inchi： 1S/C17H19O5P/c1-3-20-17(18)14(2)23(19,21-15-10-6-4-7-11-15)22-16-12-8-5-9-13-16/h4-14H,3H2,1-2H3
- InChI Key： UCJROHIRYPUQFH-UHFFFAOYSA-N
- SMILES： P(C(C(=O)OCC)C)(=O)(OC1C=CC=CC=1)OC1C=CC=CC=1
Computed Properties
- Exact Mass: 334.09707
- Monoisotopic Mass: 334.09701070g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 8
- Complexity: 389
- 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: 3.8
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
Propanoic acid, 2-(diphenoxyphosphinyl)-, ethyl ester Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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