Cas no 59344-04-6 (Propanoic acid, 3-(dimethylphenylsilyl)-, methyl ester)
59344-04-6 structure
Product Name:Propanoic acid, 3-(dimethylphenylsilyl)-, methyl ester
CAS No:59344-04-6
MF:C12H18O2Si
MW:222.355624675751
CID:339046
PubChem ID:12630293
Update Time:2025-04-19
Propanoic acid, 3-(dimethylphenylsilyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 3-(dimethylphenylsilyl)-, methyl ester
- methyl 3-[dimethyl(phenyl)silyl]propanoate
- 59344-04-6
- DTXSID80504955
-
- Inchi： 1S/C12H18O2Si/c1-14-12(13)9-10-15(2,3)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
- InChI Key： MPKMHCNCUAAGQP-UHFFFAOYSA-N
- SMILES： [Si](C)(C)(C1C=CC=CC=1)CCC(=O)OC
Computed Properties
- Exact Mass: 222.10764
- Monoisotopic Mass: 222.107606347g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 208
- 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: 26.3?2
Experimental Properties
- PSA: 26.3
Propanoic acid, 3-(dimethylphenylsilyl)-, methyl ester Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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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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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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