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3031-74-1 | Hydroperoxide, ethyl (9CI)
CAS No: 3031-74-1 Catalog No: AG002ZMJ MDL No:
Product Description
Catalog Number:
AG002ZMJ
Chemical Name:
Hydroperoxide, ethyl (9CI)
CAS Number:
3031-74-1
Molecular Formula:
C2H6O2
Molecular Weight:
62.0678
IUPAC Name:
hydroperoxyethane
InChI:
InChI=1S/C2H6O2/c1-2-4-3/h3H,2H2,1H3
InChI Key:
ILHIHKRJJMKBEE-UHFFFAOYSA-N
SMILES:
CCOO
EC Number:
221-211-6
UNII:
08608DV9AD
Properties
Complexity:
8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
62.037g/mol
Formal Charge:
0
Heavy Atom Count:
4
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
62.068g/mol
Monoisotopic Mass:
62.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| O-H stretch overtone excitation of ethyl hydroperoxide conformers. | The journal of physical chemistry. A 20111208 |
| Unimolecular decomposition of ethyl hydroperoxide: ab initio/Rice-Ramsperger-Kassel-Marcus theoretical prediction of rate constants. | The journal of physical chemistry. A 20110210 |
| Study of a benzoylperoxy radical in the gas phase: ultraviolet spectrum and C6H5C(O)O2 + HO2 reaction between 295 and 357 K. | The journal of physical chemistry. A 20100930 |
| Polymer molecular weight-dependent unusual fluorescence probe behavior within 1-butyl-3-methylimidazolium hexafluorophosphate+poly(ethylene glycol). | The journal of physical chemistry. B 20090528 |
| Preparation, Characterization and Sensitive Gas Sensing of Conductive Core-sheath TiO(2)-PEDOT Nanocables. | Sensors (Basel, Switzerland) 20090101 |
| [Angiotensin III participation in mechanisms of development of an alcoholism and other kinds of behavioural activity]. | Georgian medical news 20081101 |
| Establishment of the C(2)H(5)+O(2) reaction mechanism: a combustion archetype. | The Journal of chemical physics 20080221 |
| Vibrational-torsional excitation and direct overtone photodissociation of ethyl hydroperoxide at 5nuOH. | The journal of physical chemistry. A 20080214 |
| Oxyferryl heme and not tyrosyl radical is the likely culprit in prostaglandin H synthase-1 peroxidase inactivation. | Biochemistry 20070116 |
| Energy-resolved photoionization of alkylperoxy radicals and the stability of their cations. | Journal of the American Chemical Society 20061018 |
| Study of benzylperoxy radical using laser photolysis: ultraviolet spectrum, self-reaction, and reaction with HO2 kinetics. | The journal of physical chemistry. A 20060629 |
| Structural changes of phenylalanine 338 and histidine 447 revealed by the crystal structures of tabun-inhibited murine acetylcholinesterase. | Biochemistry 20060110 |
| A systematic computational study of the reactions of HO2 with RO2: the HO2 + C2H5O2 reaction. | The journal of physical chemistry. A 20051215 |
| New metabolically stabilized analogues of lysophosphatidic acid: agonists, antagonists and enzyme inhibitors. | Biochemical Society transactions 20051201 |
| [Determination of peroxides in environmental samples by high performance liquid chromatography with fluorescence detection]. | Se pu = Chinese journal of chromatography 20050701 |
| High-field EPR study of tyrosyl radicals in prostaglandin H(2) synthase-1. | Biochemistry 20020514 |
| Negative-ion photoelectron spectroscopy, gas-phase acidity, and thermochemistry of the peroxyl radicals CH(3)OO and CH(3)CH(2)OO. | Journal of the American Chemical Society 20011003 |
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