Basic information
- CAS
16720-19-7- Standard SMILES
CO[Si](CCSC(C)=O)(OC)OC- InChIKey
VTDGQIKUNVKXLV-UHFFFAOYSA-N- Molecular formula
- C7H16O4SSi
- Average molar mass
- 224.35 g/mol
- Monoisotopic mass
- 224.0538567
Names & identifiers
- Preferred name
- Acetic acid, thio-, S-ester with (2-mercaptoethyl)trimethoxysilane
- IUPAC
- S-(2-trimethoxysilylethyl) ethanethioate
- English name
- Thioacetic acid S-[2-(trimethoxysilyl)ethyl] ester
- Molecular formula
- C7H16O4SSi
- Molecular weight
- 224.35
Names & synonyms
BRN 225085316720-19-7Silane, (2-acetothioethyl)trimethoxy-Ethanethiol, 2-(trimethoxysilyl)-, thioacetateACETIC ACID, THIO-, S-ESTER with (2-MERCAPTOETHYL)TRIMETHOXYSILANEDTXSID90168249RefChem:316704DTXCID6090740S-(2-trimethoxysilylethyl) ethanethioateThioacetic acid S-[2-(trimethoxysilyl)ethyl] esterSCHEMBL3656326S-[2-(Trimethoxysilyl)ethyl] ethanethioate
Show more names
Ethanethioic acid, S-[2-(trimethoxysilyl)ethyl] ester
Database identifiers
- CAS
16720-19-7- PubChem CID
- 28013
- DTXSID
DTXSID90168249- Nikkaji
- J54.979G
Properties
Computed structural properties
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 152
Physicochemical properties
- Boiling point
- 214.6 · 214.6±23.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…