Cas no 5106-47-8 (Cyclohexanecarboperoxoic acid)
Cyclohexanecarboperoxoic acid structure
Product Name:Cyclohexanecarboperoxoic acid
CAS No:5106-47-8
MF:C7H12O3
MW:144.168382644653
CID:363487
PubChem ID:10953641
Update Time:2025-04-19
Cyclohexanecarboperoxoic acid Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboperoxoic acid
- 5106-47-8
- SCHEMBL2597871
- chpca
- DTXSID80449514
-
- Inchi： 1S/C7H12O3/c8-7(10-9)6-4-2-1-3-5-6/h6,9H,1-5H2
- InChI Key： BVPBPBQDQZIFSK-UHFFFAOYSA-N
- SMILES： O(C(C1CCCCC1)=O)O
Computed Properties
- Exact Mass: 144.07866
- Monoisotopic Mass: 144.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 116
- 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: 1.7
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
Cyclohexanecarboperoxoic acid Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Peroxycarboxylic acids
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Peroxycarboxylic acids and derivatives Peroxycarboxylic acids
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