tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane

C25H46O2Si2 — CID 18922427

IUPACtert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC(c1ccccc1)C(C)(C)[Si](C)(C)OCC1CCCCC1
InChIInChI=1S/C25H46O2Si2/c1-24(2,3)28(6,7)27-23(22-18-14-11-15-19-22)25(4,5)29(8,9)26-20-21-16-12-10-13-17-21/h11,14-15,18-19,21,23H,10,12-13,16-17,20H2,1-9H3
InChIKeyWBYLWFXALUWAHC-UHFFFAOYSA-N
MW434.81 g/mol
LogP8.33
Rot. Bonds8

About tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane

tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane (PubChem CID 18922427) has the molecular formula C25H46O2Si2 and a molecular weight of 434.81 g/mol. Its IUPAC name is tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane
PubChem CID18922427
Molecular FormulaC25H46O2Si2
Molecular Weight434.81 g/mol
Exact Mass434.30
IUPAC Nametert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC(c1ccccc1)C(C)(C)[Si](C)(C)OCC1CCCCC1
InChIInChI=1S/C25H46O2Si2/c1-24(2,3)28(6,7)27-23(22-18-14-11-15-19-22)25(4,5)29(8,9)26-20-21-16-12-10-13-17-21/h11,14-15,18-19,21,23H,10,12-13,16-17,20H2,1-9H3
InChIKeyWBYLWFXALUWAHC-UHFFFAOYSA-N
XLogP8.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.81
LogP ≤ 58.33
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

Benzyloxytrimethylsilane
CID 518982
Silane, (2-chloroethyl)methylbis(phenylmethoxy)-
CID 94518
(3S,6S)-3-cyclohexyl-6-phenyl-3,6-dihydro-1,2-dioxine
CID 44297715
Silane, triethyl(phenylmethoxy)-
CID 563229
Silane, trimethyl(1-phenylethoxy)-
CID 519015
1,2-Ethanediol, phenyl, bis-TMS
CID 530367
1-Propanol, 1-phenyl, TMS
CID 530376
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
tert-Butyl-[2-(tertbutyldimethylsilyl)oxy-1-phenylethoxy]dimethylsilane
CID 11100658
Dimethyl(diphenylmethoxy)(pentafluorophenyl)silane
CID 4581060
4-(Trimethylsilyl)benzhydrol
CID 3551384
1-(1-Phenylbutan-2-yloxydisulfanyl)oxypropylbenzene
CID 70694172

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane (CID 18922427) is tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OC(c1ccccc1)C(C)(C)[Si](C)(C)OCC1CCCCC1.
What is the InChIKey of tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane?
The InChIKey is WBYLWFXALUWAHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H46O2Si2/c1-24(2,3)28(6,7)27-23(22-18-14-11-15-19-22)25(4,5)29(8,9)26-20-21-16-12-10-13-17-21/h11,14-15,18-19,21,23H,10,12-13,16-17,20H2,1-9H3.
What are the key properties of tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane?
tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane has a molecular weight of 434.81 g/mol, XLogP of 8.33, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[cyclohexylmethoxy(dimethyl)silyl]-2-methyl-1-phenylpropoxy]-dimethylsilane is sourced from PubChem (CID 18922427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).