4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol

C24H34O2Si — CID 66761813

IUPAC4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol
SMILESCC1(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CCC(O)CC1
InChIInChI=1S/C24H34O2Si/c1-23(2,3)27(21-11-7-5-8-12-21,22-13-9-6-10-14-22)26-19-24(4)17-15-20(25)16-18-24/h5-14,20,25H,15-19H2,1-4H3
InChIKeyZPTFIILLAJTKSS-UHFFFAOYSA-N
MW382.62 g/mol
LogP4.50
Rot. Bonds5

About 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol

4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol (PubChem CID 66761813) has the molecular formula C24H34O2Si and a molecular weight of 382.62 g/mol. Its IUPAC name is 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol
PubChem CID66761813
Molecular FormulaC24H34O2Si
Molecular Weight382.62 g/mol
Exact Mass382.23
IUPAC Name4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol
SMILESCC1(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CCC(O)CC1
InChIInChI=1S/C24H34O2Si/c1-23(2,3)27(21-11-7-5-8-12-21,22-13-9-6-10-14-22)26-19-24(4)17-15-20(25)16-18-24/h5-14,20,25H,15-19H2,1-4H3
InChIKeyZPTFIILLAJTKSS-UHFFFAOYSA-N
XLogP4.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.62
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 174251063
1-bicyclo[1.1.1]pentanylmethoxy-tert-butyl-diphenylsilane
CID 142733105
2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 74035630
tert-butyl-[(2-methylthiiran-2-yl)methoxy]-diphenylsilane
CID 140876888
tert-butyl-[[(2S)-2-methyloxiran-2-yl]methoxy]-diphenylsilane
CID 11290341
5-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-hydroxy-5-methylcyclohex-2-en-1-one
CID 140892968
trans-(1R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methylidenecyclopentan-1-ol
CID 101065622
3-[[tert-butyl(diphenyl)silyl]oxymethyl]thian-4-ol
CID 122207177
[(1R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,2,2-trimethylcyclopentyl]methanol
CID 15443826
tert-butyl-[4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methoxycyclohexyl]carbamic acid
CID 70871740
[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol
CID 16736190
(2S,3R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-ethenyl-2-methoxyoxolan-3-ol
CID 99772772

Frequently Asked Questions

What is the IUPAC name of 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol?
The IUPAC name of 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol (CID 66761813) is 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol.
What is the SMILES notation for 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol?
The canonical SMILES for 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol is CC1(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CCC(O)CC1.
What is the InChIKey of 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol?
The InChIKey is ZPTFIILLAJTKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34O2Si/c1-23(2,3)27(21-11-7-5-8-12-21,22-13-9-6-10-14-22)26-19-24(4)17-15-20(25)16-18-24/h5-14,20,25H,15-19H2,1-4H3.
What are the key properties of 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol?
4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol has a molecular weight of 382.62 g/mol, XLogP of 4.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-methylcyclohexan-1-ol is sourced from PubChem (CID 66761813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).