Cas no 93636-83-0 (1,3,5-Trioxane, 2,4,6-tris(4-chlorobutyl)-)
93636-83-0 structure
Product Name:1,3,5-Trioxane, 2,4,6-tris(4-chlorobutyl)-
CAS No:93636-83-0
MF:C15H27Cl3O3
MW:361.732082605362
CID:2817238
Update Time:2023-08-07
1,3,5-Trioxane, 2,4,6-tris(4-chlorobutyl)- Chemical and Physical Properties
Names and Identifiers
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- 1,3,5-Trioxane, 2,4,6-tris(4-chlorobutyl)-
- 2,4,6-TRIS(4-CHLOROBUTYL)-1,3,5-TRIOXANE
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- Inchi: 1S/C15H27Cl3O3/c16-10-4-1-7-13-19-14(8-2-5-11-17)21-15(20-13)9-3-6-12-18/h13-15H,1-12H2
- InChI Key: UDKOZWSLXRXQET-UHFFFAOYSA-N
- SMILES: ClCCCCC1OC(CCCCCl)OC(CCCCCl)O1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 194
- XLogP3: 5
- Topological Polar Surface Area: 27.7
1,3,5-Trioxane, 2,4,6-tris(4-chlorobutyl)- Related Literature
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1. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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4. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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