Basic information
- CAS
55590-74-4- Standard SMILES
COC(=O)CC(C)O[Si](C)(C)C- InChIKey
FHDCVPMIQWHEAE-UHFFFAOYSA-N- Molecular formula
- C8H18O3Si
- Average molar mass
- 190.31 g/mol
- Monoisotopic mass
- 190.10252097
Names & identifiers
- Preferred name
- Methyl 3-[(trimethylsilyl)oxy]butanoate
- IUPAC
- methyl 3-trimethylsilyloxybutanoate
- English name
- 3-(Trimethylsiloxy)butanoic acid methyl ester
- Molecular formula
- C8H18O3Si
- Molecular weight
- 190.31
Names & synonyms
55590-74-4Methyl 3-hydroxybutyrate, TMS derivativeMethyl 3-[(trimethylsilyl)oxy]butanoate3-(Trimethylsiloxy)butanoic acid methyl esterButanoic acid, 3-[(trimethylsilyl)oxy]-, methyl esterFHDCVPMIQWHEAE-UHFFFAOYSA-NDTXSID101346997Methyl 3-[(trimethylsilyl)oxy]butanoate #DB-303989
Database identifiers
- CAS
55590-74-4- PubChem CID
- 560665
- DTXSID
DTXSID101346997- Nikkaji
- J109.140I
Properties
Computed structural properties
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 151
Physicochemical properties
- Boiling point
- 167.8 · 167.8±13.0 °C(Predicted)
- Density
- 0.921 · 0.921±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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