Acetic acid, phenyl(trimethylsiloxy)-, methyl ester
Basic information
- CAS
29233-93-0- Standard SMILES
COC(=O)C(O[Si](C)(C)C)c1ccccc1- InChIKey
PLWQGQBXGJUDPX-UHFFFAOYSA-N- Molecular formula
- C12H18O3Si
- Average molar mass
- 238.35 g/mol
- Monoisotopic mass
- 238.10252097
Names & identifiers
- Preferred name
- Acetic acid, phenyl(trimethylsiloxy)-, methyl ester
- IUPAC
- methyl 2-phenyl-2-trimethylsilyloxyacetate
- English name
- α-(Trimethylsiloxy)benzeneacetic acid methyl ester
- Molecular formula
- C12H18O3Si
- Molecular weight
- 238.35
Names & synonyms
Methyl mandelate, TMS derivativeAcetic acid, phenyl(trimethylsiloxy)-, methyl esterPLWQGQBXGJUDPX-UHFFFAOYSA-NDTXSID501346313Benzeneacetic acid, .alpha.-[(trimethylsilyl)oxy]-, methyl esterMethyl phenyl[(trimethylsilyl)oxy]acetate29233-93-0Methyl phenyl[(trimethylsilyl)oxy]acetate #Mandelic acid methyl ester trimethylsilyl ether2-Hydroxyphenylacetic acid, trimethylsilyl-, methyl esterTrimethylsilyl derivative of methyl ester of Mandelic acidα-(Trimethylsiloxy)benzeneacetic acid methyl ester
Show more names
Benzeneacetic acid, α-[(trimethylsilyl)oxy]-, methyl ester
Database identifiers
- CAS
29233-93-0- PubChem CID
- 601544
- DTXSID
DTXSID501346313- Nikkaji
- J109.152B
Properties
Computed structural properties
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Boiling point
- 273.6 · 273.6±28.0 °C(Predicted)
- Density
- 1.015 · 1.015±0.06 g/cm3(Predicted)
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Compound notes
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