Cas no 63620-95-1 (Phosphonic acid, (2-oxoethyl)-, bis(2-methylpropyl) ester)
63620-95-1 structure
Product Name:Phosphonic acid, (2-oxoethyl)-, bis(2-methylpropyl) ester
CAS No:63620-95-1
MF:C10H21O4P
MW:236.245104551315
CID:426092
PubChem ID:13103934
Update Time:2025-04-19
Phosphonic acid, (2-oxoethyl)-, bis(2-methylpropyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphonic acid, (2-oxoethyl)-, bis(2-methylpropyl) ester
- 2-[bis(2-methylpropoxy)phosphoryl]acetaldehyde
- DTXSID10518247
- Bis(2-methylpropyl) (2-oxoethyl)phosphonate
- 63620-95-1
-
- Inchi: 1S/C10H21O4P/c1-9(2)7-13-15(12,6-5-11)14-8-10(3)4/h5,9-10H,6-8H2,1-4H3
- InChI Key: POPDXLYCGWQSIQ-UHFFFAOYSA-N
- SMILES: P(CC=O)(=O)(OCC(C)C)OCC(C)C
Computed Properties
- Exact Mass: 236.11783
- Monoisotopic Mass: 236.11774614g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 8
- Complexity: 210
- 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: 1.7
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
Phosphonic acid, (2-oxoethyl)-, bis(2-methylpropyl) ester Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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