(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one

C15H24O2Si — CID 14121070

IUPAC(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one
SMILESCC(=O)[C@H](O[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C15H24O2Si/c1-12(16)14(13-10-8-7-9-11-13)17-18(5,6)15(2,3)4/h7-11,14H,1-6H3/t14-/m0/s1
InChIKeyURCNTBZJQUYYIV-AWEZNQCLSA-N
MW264.44 g/mol
LogP4.34
Rot. Bonds4

About (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one

(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one (PubChem CID 14121070) has the molecular formula C15H24O2Si and a molecular weight of 264.44 g/mol. Its IUPAC name is (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one.

Molecular Properties

Compound Name(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one
PubChem CID14121070
Molecular FormulaC15H24O2Si
Molecular Weight264.44 g/mol
Exact Mass264.15
IUPAC Name(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one
SMILESCC(=O)[C@H](O[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C15H24O2Si/c1-12(16)14(13-10-8-7-9-11-13)17-18(5,6)15(2,3)4/h7-11,14H,1-6H3/t14-/m0/s1
InChIKeyURCNTBZJQUYYIV-AWEZNQCLSA-N
XLogP4.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one?
The IUPAC name of (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one (CID 14121070) is (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one.
What is the SMILES notation for (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one?
The canonical SMILES for (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one is CC(=O)[C@H](O[Si](C)(C)C(C)(C)C)c1ccccc1.
What is the InChIKey of (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one?
The InChIKey is URCNTBZJQUYYIV-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H24O2Si/c1-12(16)14(13-10-8-7-9-11-13)17-18(5,6)15(2,3)4/h7-11,14H,1-6H3/t14-/m0/s1.
What are the key properties of (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one?
(1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one has a molecular weight of 264.44 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-one is sourced from PubChem (CID 14121070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).