Cas no 918866-12-3 (Dodecanoic acid, 2-acetyl-, 3-(trimethoxysilyl)propyl ester)
918866-12-3 structure
Product Name:Dodecanoic acid, 2-acetyl-, 3-(trimethoxysilyl)propyl ester
CAS No:918866-12-3
MF:C20H40O6Si
MW:404.613508224487
CID:769904
PubChem ID:71426256
Update Time:2025-04-19
Dodecanoic acid, 2-acetyl-, 3-(trimethoxysilyl)propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoic acid, 2-acetyl-, 3-(trimethoxysilyl)propyl ester
- 3-trimethoxysilylpropyl 2-acetyldodecanoate
- 918866-12-3
- 3-(TRIMETHOXYSILYL)PROPYL 2-ACETYLDODECANOATE
- DTXSID80845017
-
- Inchi： 1S/C20H40O6Si/c1-6-7-8-9-10-11-12-13-15-19(18(2)21)20(22)26-16-14-17-27(23-3,24-4)25-5/h19H,6-17H2,1-5H3
- InChI Key： OQILPZODYZKBLJ-UHFFFAOYSA-N
- SMILES： [Si](CCCOC(C(C(C)=O)CCCCCCCCCC)=O)(OC)(OC)OC
Computed Properties
- Exact Mass: 404.25941553g/mol
- Monoisotopic Mass: 404.25941553g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 27
- Rotatable Bond Count: 19
- Complexity: 390
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 71.1?2
Experimental Properties
- PSA: 71.06000
- LogP: 4.53380
Dodecanoic acid, 2-acetyl-, 3-(trimethoxysilyl)propyl ester Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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