Cas no 57640-10-5 (4-(triethoxysilyl)butane-2-thiol)
57640-10-5 structure
Product Name:4-(triethoxysilyl)butane-2-thiol
CAS No:57640-10-5
MF:C10H24O3SSi
MW:252.446263313293
CID:947343
PubChem ID:93746
Update Time:2025-04-19
4-(triethoxysilyl)butane-2-thiol Chemical and Physical Properties
Names and Identifiers
-
- 4-(triethoxysilyl)butane-2-thiol
- 4-triethoxysilylbutane-2-thiol
- EINECS 260-870-4
- 2-BUTANETHIOL, 4-(TRIETHOXYSILYL)-
- NTT32BV42Q
- UNII-NTT32BV42Q
- 4-(Triethoxysilyl)-2-butanethiol
- DTXSID30973218
- XUGBJJNOIWRRPH-UHFFFAOYSA-N
- NS00053883
- SCHEMBL375287
- 57640-10-5
-
- Inchi： 1S/C10H24O3SSi/c1-5-11-15(12-6-2,13-7-3)9-8-10(4)14/h10,14H,5-9H2,1-4H3
- InChI Key： XUGBJJNOIWRRPH-UHFFFAOYSA-N
- SMILES： SC(C)CC[Si](OCC)(OCC)OCC
Computed Properties
- Exact Mass: 252.12162
- Monoisotopic Mass: 252.12154233g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 9
- Complexity: 141
- 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: 28.7?2
Experimental Properties
- PSA: 27.69
4-(triethoxysilyl)butane-2-thiol Related Literature
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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