1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone

C15H24O2Si — CID 171363881

IUPAC1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone
SMILESCC(=O)c1cccc(CO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H24O2Si/c1-12(16)14-9-7-8-13(10-14)11-17-18(5,6)15(2,3)4/h7-10H,11H2,1-6H3
InChIKeyORMZIMWRMVPUGB-UHFFFAOYSA-N
MW264.44 g/mol
LogP4.41
Rot. Bonds4

About 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone

1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone (PubChem CID 171363881) has the molecular formula C15H24O2Si and a molecular weight of 264.44 g/mol. Its IUPAC name is 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone.

Molecular Properties

Compound Name1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone
PubChem CID171363881
Molecular FormulaC15H24O2Si
Molecular Weight264.44 g/mol
Exact Mass264.15
IUPAC Name1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone
SMILESCC(=O)c1cccc(CO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H24O2Si/c1-12(16)14-9-7-8-13(10-14)11-17-18(5,6)15(2,3)4/h7-10H,11H2,1-6H3
InChIKeyORMZIMWRMVPUGB-UHFFFAOYSA-N
XLogP4.41
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 ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-one
CID 70662263
tert-butyl-dimethyl-[[3-(1-phenylethenyl)phenyl]methoxy]silane
CID 86054113
3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenol
CID 14940556
tert-butyl-dimethyl-[(3-methylphenyl)methoxy]silane
CID 22967275
[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanamine
CID 22049979
tert-butyl-[(3-iodophenyl)methoxy]-dimethylsilane
CID 66845200
[3-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane;[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanol
CID 159353997
tert-butyl-dimethyl-[[3-(2-methylprop-2-enoxy)phenyl]methoxy]silane
CID 57096912
3-[[tert-butyl(dimethyl)silyl]oxymethyl]benzonitrile
CID 22050298
1-[3-(methoxymethyl)phenyl]ethanone;1-[4-(methoxymethyl)phenyl]ethanone
CID 54297695
tert-butyl-[2-[1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethenoxy]-2-phenylethoxy]-dimethylsilane
CID 21224724
methyl 3-amino-6-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]pyrazine-2-carboxylate
CID 58710604

Frequently Asked Questions

What is the IUPAC name of 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone?
The IUPAC name of 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone (CID 171363881) is 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone.
What is the SMILES notation for 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone?
The canonical SMILES for 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone is CC(=O)c1cccc(CO[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone?
The InChIKey is ORMZIMWRMVPUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2Si/c1-12(16)14-9-7-8-13(10-14)11-17-18(5,6)15(2,3)4/h7-10H,11H2,1-6H3.
What are the key properties of 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone?
1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone has a molecular weight of 264.44 g/mol, XLogP of 4.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone is sourced from PubChem (CID 171363881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).