Cas no 5618-63-3 (Tertiary-butylhydroperoxide)
Tertiary-butylhydroperoxide structure
Product Name:Tertiary-butylhydroperoxide
CAS No:5618-63-3
MF:C4H10O2
MW:90.1210017204285
CID:2667129
PubChem ID:13651101
Update Time:2025-04-21
Tertiary-butylhydroperoxide Chemical and Physical Properties
Names and Identifiers
-
- 1-hydroperoxy-2-methylpropane
- Tertiary-butylhydroperoxide
- DTXSID80545868
- I-butyl hydroperoxide
- 5618-63-3
- 2-Methylpropane-1-peroxol
- isobutyl hydroperoxide
-
- Inchi: 1S/C4H10O2/c1-4(2)3-6-5/h4-5H,3H2,1-2H3
- InChI Key: FUHWWEDRJKHMKK-UHFFFAOYSA-N
- SMILES: O(CC(C)C)O
Computed Properties
- Exact Mass: 90.068079557g/mol
- Monoisotopic Mass: 90.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 6
- Rotatable Bond Count: 2
- Complexity: 26.7
- 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: 0.9
- Topological Polar Surface Area: 29.5?2
Tertiary-butylhydroperoxide Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
5618-63-3 (Tertiary-butylhydroperoxide) Related Products
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