methyl 2-phenyl-2-trimethylsilyloxyacetate

C12H18O3Si — CID 601544

IUPACmethyl 2-phenyl-2-trimethylsilyloxyacetate
SMILESCOC(=O)C(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C12H18O3Si/c1-14-12(13)11(15-16(2,3)4)10-8-6-5-7-9-10/h5-9,11H,1-4H3
InChIKeyPLWQGQBXGJUDPX-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.75
Rot. Bonds4

About methyl 2-phenyl-2-trimethylsilyloxyacetate

methyl 2-phenyl-2-trimethylsilyloxyacetate (PubChem CID 601544) has the molecular formula C12H18O3Si and a molecular weight of 238.36 g/mol. Its IUPAC name is methyl 2-phenyl-2-trimethylsilyloxyacetate.

Molecular Properties

Compound Namemethyl 2-phenyl-2-trimethylsilyloxyacetate
PubChem CID601544
Molecular FormulaC12H18O3Si
Molecular Weight238.36 g/mol
Exact Mass238.10
IUPAC Namemethyl 2-phenyl-2-trimethylsilyloxyacetate
SMILESCOC(=O)C(O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C12H18O3Si/c1-14-12(13)11(15-16(2,3)4)10-8-6-5-7-9-10/h5-9,11H,1-4H3
InChIKeyPLWQGQBXGJUDPX-UHFFFAOYSA-N
XLogP2.75
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-phenyl-1-trimethylsilyloxypropan-2-one
CID 14957195
methyl 2-phenyl-2-propan-2-yloxyacetate
CID 75094315
methyl (2S)-2-phenyl-2-propan-2-yloxyacetate
CID 102179999
[(1R)-2-methoxy-2-oxo-1-phenylethyl] benzoate
CID 11747638
methyl 2-(2-bromoacetyl)oxy-2-phenylacetate
CID 87076248
methyl 2-phenyl-2-(trifluoromethylsulfonyloxy)acetate
CID 14104123
(2-methoxy-2-oxo-1-phenylethyl) 3-oxobutanoate
CID 54537935
methyl (2S)-2-phenyl-2-tris(trimethylsilyl)silylacetate
CID 15864605
methyl (2R)-2-[(1S)-2-oxo-1-phenylethoxy]-2-phenylacetate
CID 11108847
methyl 2-phenyl-3-trimethylsilyloxypropanoate
CID 552740
methyl 2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]oxy-2-phenylacetate
CID 122393653
methyl (2R)-2-phenyl-2-prop-2-enoxyacetate
CID 5324854

Frequently Asked Questions

What is the IUPAC name of methyl 2-phenyl-2-trimethylsilyloxyacetate?
The IUPAC name of methyl 2-phenyl-2-trimethylsilyloxyacetate (CID 601544) is methyl 2-phenyl-2-trimethylsilyloxyacetate.
What is the SMILES notation for methyl 2-phenyl-2-trimethylsilyloxyacetate?
The canonical SMILES for methyl 2-phenyl-2-trimethylsilyloxyacetate is COC(=O)C(O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of methyl 2-phenyl-2-trimethylsilyloxyacetate?
The InChIKey is PLWQGQBXGJUDPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3Si/c1-14-12(13)11(15-16(2,3)4)10-8-6-5-7-9-10/h5-9,11H,1-4H3.
What are the key properties of methyl 2-phenyl-2-trimethylsilyloxyacetate?
methyl 2-phenyl-2-trimethylsilyloxyacetate has a molecular weight of 238.36 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-phenyl-2-trimethylsilyloxyacetate is sourced from PubChem (CID 601544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).