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

C22H30O2Si — CID 15632834

IUPAC4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol
SMILESCC(C)(C)[Si](OC1CCC(O)CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H30O2Si/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19,23H,14-17H2,1-3H3
InChIKeyLXGBGZOYKCDRQU-UHFFFAOYSA-N
MW354.57 g/mol
LogP3.87
Rot. Bonds4

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

4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol (PubChem CID 15632834) has the molecular formula C22H30O2Si and a molecular weight of 354.57 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol
PubChem CID15632834
Molecular FormulaC22H30O2Si
Molecular Weight354.57 g/mol
Exact Mass354.20
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol
SMILESCC(C)(C)[Si](OC1CCC(O)CC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H30O2Si/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19,23H,14-17H2,1-3H3
InChIKeyLXGBGZOYKCDRQU-UHFFFAOYSA-N
XLogP3.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.57
LogP ≤ 53.87
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

3-((tert-Butyldiphenylsilyl)oxy)-2,2-dimethylpropan-1-ol
CID 11313883
Tert-butyl-cyclohexyloxy-diphenylsilane
CID 12619131
6-((tert-Butyldiphenylsilyl)oxy)hexan-1-ol
CID 11013734
(R)-4-(tert-Butyldiphenylsilyloxy)-3-methyl-1-butanol
CID 23727941
1-[Tert-butyl(diphenyl)silyl]oxy-4,4-difluorohex-5-en-3-ol
CID 102342231
1-Butanol, 4-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-
CID 10065108
3-(Tert-butyldiphenylsiloxy)propanol
CID 10245134
(S)-4-(tert-butyldiphenylsilyloxy)-2-methylbutan-1-ol
CID 10712362
(3R)-1-[tert-butyl(diphenyl)silyl]oxyhex-5-en-3-ol
CID 10915232
5-(tert-Butyldiphenylsilyloxy)pentan-1-ol
CID 10925936
(2S)-3-{[tert-butyl(diphenyl)silyl]oxy}-2-methyl-1-propanol
CID 11088763
((1S,2R)-2-(((tert-Butyldiphenylsilyl)oxy)methyl)cyclopropyl)methanol
CID 11131629

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol (CID 15632834) is 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol is CC(C)(C)[Si](OC1CCC(O)CC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol?
The InChIKey is LXGBGZOYKCDRQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30O2Si/c1-22(2,3)25(20-10-6-4-7-11-20,21-12-8-5-9-13-21)24-19-16-14-18(23)15-17-19/h4-13,18-19,23H,14-17H2,1-3H3.
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol?
4-[tert-butyl(diphenyl)silyl]oxycyclohexan-1-ol has a molecular weight of 354.57 g/mol, XLogP of 3.87, 4 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]oxycyclohexan-1-ol is sourced from PubChem (CID 15632834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).