Cas no 93776-40-0 (Silicic acid (H4SiO4),tetraisotridecyl ester (9CI))
93776-40-0 structure
Product Name:Silicic acid (H4SiO4),tetraisotridecyl ester (9CI)
CAS No:93776-40-0
MF:C52H108O4Si
MW:825.497038841248
CID:817322
PubChem ID:44145071
Update Time:2025-04-19
Silicic acid (H4SiO4),tetraisotridecyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Silicic acid (H4SiO4),tetraisotridecyl ester (9CI)
- tetra(isotridecyl) orthosilicate
- tetrakis(11-methyldodecyl) silicate
- EINECS 297-969-7
- DTXSID10918122
- 93776-40-0
- Tetrakis(11-methyldodecyl) orthosilicate
- Tetra(isotridecyl)orthosilicate
-
- Inchi： 1S/C52H108O4Si/c1-49(2)41-33-25-17-9-13-21-29-37-45-53-57(54-46-38-30-22-14-10-18-26-34-42-50(3)4,55-47-39-31-23-15-11-19-27-35-43-51(5)6)56-48-40-32-24-16-12-20-28-36-44-52(7)8/h49-52H,9-48H2,1-8H3
- InChI Key： TZSCJUXOSBZDMS-UHFFFAOYSA-N
- SMILES： [Si](OCCCCCCCCCCC(C)C)(OCCCCCCCCCCC(C)C)(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C
Computed Properties
- Exact Mass: 824.802
- Monoisotopic Mass: 824.802
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 57
- Rotatable Bond Count: 48
- Complexity: 631
- 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
- Topological Polar Surface Area: 36.9A^2
Experimental Properties
- PSA: 36.92000
- LogP: 18.15600
Silicic acid (H4SiO4),tetraisotridecyl ester (9CI) Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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