Cas no 85951-08-2 (1,2-Propanediol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-)
85951-08-2 structure
Product Name:1,2-Propanediol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
CAS No:85951-08-2
MF:C9H22O3Si
MW:206.354684352875
CID:662876
PubChem ID:11401499
Update Time:2025-04-19
1,2-Propanediol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Propanediol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-
- 3-[tert-butyl(dimethyl)silyl]oxypropane-1,2-diol
- SCHEMBL9428149
- 85951-08-2
- DTXSID00464724
-
- Inchi: 1S/C9H22O3Si/c1-9(2,3)13(4,5)12-7-8(11)6-10/h8,10-11H,6-7H2,1-5H3
- InChI Key: HLZIALBLRJXNQN-UHFFFAOYSA-N
- SMILES: [Si](C)(C)(C(C)(C)C)OCC(CO)O
Computed Properties
- Exact Mass: 206.13382109g/mol
- Monoisotopic Mass: 206.13382109g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 151
- 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: 49.7?2
Experimental Properties
- PSA: 49.69000
- LogP: 1.36140
1,2-Propanediol, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]- Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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