Cas no 138343-26-7 (Hydroperoxide,1-(ethyldioxy)ethyl (9CI))
138343-26-7 structure
Product Name:Hydroperoxide,1-(ethyldioxy)ethyl (9CI)
CAS No:138343-26-7
MF:C4H10O4
MW:122.119801998138
CID:204996
PubChem ID:3035689
Update Time:2025-04-19
Hydroperoxide,1-(ethyldioxy)ethyl (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Hydroperoxide,1-(ethyldioxy)ethyl (9CI)
- 1-ethylperoxy-1-hydroperoxyethane
- 1-(ethylperoxy)ethyl hydroperoxide
- alpha-Hydroperoxy diethyl peroxide
- BRN 4796731
- Hydroperoxide, 1-(ethyldioxy)ethyl
- Hydroperoxydiethyl peroxide
- DTXSID70930067
- Alpha-hydroperoxydiethyl peroxide
- 138343-26-7
- 1-(Ethylperoxy)ethane-1-peroxol
-
- Inchi： 1S/C4H10O4/c1-3-6-8-4(2)7-5/h4-5H,3H2,1-2H3
- InChI Key： PKLRNOIIJPCHSR-UHFFFAOYSA-N
- SMILES： O(C(C)OO)OCC
Computed Properties
- Exact Mass: 122.0579
- Monoisotopic Mass: 122.057909
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 47.3
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 0.4
- Topological Polar Surface Area: 47.9
Experimental Properties
- Density: 1.094
- Boiling Point: 154.5°Cat760mmHg
- Flash Point: 47.3°C
- Refractive Index: 1.404
- PSA: 47.92
Hydroperoxide,1-(ethyldioxy)ethyl (9CI) Related Literature
-
Dee Ann Casteel Nat. Prod. Rep. 1999 16 55
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