Cas no 82426-28-6 (Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester)
82426-28-6 structure
Product Name:Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester
CAS No:82426-28-6
MF:C8H17O5P
MW:225.183998823166
CID:708403
PubChem ID:24857644
Update Time:2025-04-19
Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester
- ethyl 2-diethoxyphosphorylacetate
- TRIETHYL PHOSPHONOACETATE-2-13C
- TRIETHYL PHOSPHONOACETATE-2-13C, 99 ATOM % 13C
- Ethyl 2-(diethoxyphosphoryl)acetate-2-13C
- Ethyl (diethoxyphosphoryl)(2-~13~C)acetate
- 82426-28-6
- DTXSID80583503
- Triethyl phosphonoacetate-2-13C, 99 atom % 13C
- SCHEMBL1331297
-
- MDL： MFCD00064454
- Inchi： 1S/C8H17O5P/c1-4-11-8(9)7-14(10,12-5-2)13-6-3/h4-7H2,1-3H3/i7+1
- InChI Key： GGUBFICZYGKNTD-CDYZYAPPSA-N
- SMILES： P([13CH2]C(=O)OCC)(=O)(OCC)OCC
Computed Properties
- Exact Mass: 225.08471547g/mol
- Monoisotopic Mass: 225.08471547g/mol
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 8
- Complexity: 206
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 0.5
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- Color/Form: Not determined
- Density: 1.13?g/mL?at 25?°C(lit.)
- Boiling Point: 142-145?°C/9?mmHg(lit.)
- Flash Point: Fahrenheit: 221 ° f
Celsius: 105 ° c - Refractive Index: n20/D 1.431(lit.)
- PSA: 71.64000
- LogP: 1.81560
- Solubility: Not determined
Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
82426-28-6 (Acetic-2-13C acid,2-(diethoxyphosphinyl)-, ethyl ester) Related Products
- 311-46-6(Ethyl Dimethylphosphonoacetate)
- 867-13-0(Triethyl phosphonoacetate)
- 100940-60-1(Triethyl Phosphonoacetate-13C2)
- 113187-28-3(Allyl Diethylphosphonoacetate)
- 27784-76-5(Tert-Butyl diethylphosphonoacetate)
- 61203-67-6(Triethylphosphonoacetate-13C)
- 1067-74-9(Methyl diethylphosphonoacetate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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