2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one

C18H22O2Si — CID 22163374

IUPAC2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one
SMILESCC(C)(O[Si](C)(C)c1ccccc1)C(=O)c1ccccc1
InChIInChI=1S/C18H22O2Si/c1-18(2,17(19)15-11-7-5-8-12-15)20-21(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3
InChIKeyXCJPWJNRSAXRBG-UHFFFAOYSA-N
MW298.46 g/mol
LogP3.78
Rot. Bonds5

About 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one

2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one (PubChem CID 22163374) has the molecular formula C18H22O2Si and a molecular weight of 298.46 g/mol. Its IUPAC name is 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one.

Molecular Properties

Compound Name2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one
PubChem CID22163374
Molecular FormulaC18H22O2Si
Molecular Weight298.46 g/mol
Exact Mass298.14
IUPAC Name2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one
SMILESCC(C)(O[Si](C)(C)c1ccccc1)C(=O)c1ccccc1
InChIInChI=1S/C18H22O2Si/c1-18(2,17(19)15-11-7-5-8-12-15)20-21(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3
InChIKeyXCJPWJNRSAXRBG-UHFFFAOYSA-N
XLogP3.78
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.46
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3,3,3-tetrafluoro-2-methoxy-1-phenylpropan-1-one
CID 101146953
(2S)-2-benzoyl-2,3,3-trimethylbutanedioic acid
CID 175533382
4-[dimethyl(phenyl)silyl]benzoic acid
CID 142466925
2,2-dimethyl-1,3-diphenyl-3-trimethylsilyloxypropan-1-one
CID 122206427
1-(4-methoxyphenyl)-2-methyl-2-trimethylsilyloxypropan-1-one
CID 101490737
[dimethyl(phenyl)silyl] trifluoromethanesulfonate
CID 13495210
(1-bromo-2-methylpropan-2-yl)oxy-dimethyl-phenylsilane
CID 67245137
2-hydroxy-2-methyl-1-phenylpropan-1-one;sulfane
CID 70599278
2-methyl-2-(oxan-2-yloxy)-1-phenylpropan-1-one
CID 22163386
(2-methyl-1-oxo-1-phenylpropan-2-yl)oxymethyl acetate
CID 20547340
ethane;2,2,2-tribromo-1-phenylethanone
CID 159508588
2,2-difluoro-1,3-diphenylpropane-1,3-dione
CID 3317886

Frequently Asked Questions

What is the IUPAC name of 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one?
The IUPAC name of 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one (CID 22163374) is 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one.
What is the SMILES notation for 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one?
The canonical SMILES for 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one is CC(C)(O[Si](C)(C)c1ccccc1)C(=O)c1ccccc1.
What is the InChIKey of 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one?
The InChIKey is XCJPWJNRSAXRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2Si/c1-18(2,17(19)15-11-7-5-8-12-15)20-21(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3.
What are the key properties of 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one?
2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one has a molecular weight of 298.46 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethyl(phenyl)silyl]oxy-2-methyl-1-phenylpropan-1-one is sourced from PubChem (CID 22163374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).