Cas no 13043-86-2 (Peroxide, 1-oxobutyl 1-oxopropyl)
13043-86-2 structure
Product Name:Peroxide, 1-oxobutyl 1-oxopropyl
CAS No:13043-86-2
MF:C7H12O4
MW:160.167782783508
CID:1225757
PubChem ID:71354567
Update Time:2025-04-20
Peroxide, 1-oxobutyl 1-oxopropyl Chemical and Physical Properties
Names and Identifiers
-
- Peroxide, 1-oxobutyl 1-oxopropyl
- propanoyl butaneperoxoate
- SCHEMBL22733777
- 13043-86-2
- DTXSID50779057
-
- Inchi： 1S/C7H12O4/c1-3-5-7(9)11-10-6(8)4-2/h3-5H2,1-2H3
- InChI Key： WYULPPRZTJMYRA-UHFFFAOYSA-N
- SMILES： O(C(CCC)=O)OC(CC)=O
Computed Properties
- Exact Mass: 160.07355886g/mol
- Monoisotopic Mass: 160.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 141
- 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: 1.5
- Topological Polar Surface Area: 52.6?2
Peroxide, 1-oxobutyl 1-oxopropyl Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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