[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol

C31H34O3Si — CID 69313641

IUPAC[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol
SMILESCC(C)(C)[Si](OCc1cc(CO)cc(OCc2ccccc2)c1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H34O3Si/c1-31(2,3)35(29-15-9-5-10-16-29,30-17-11-6-12-18-30)34-24-27-19-26(22-32)20-28(21-27)33-23-25-13-7-4-8-14-25/h4-21,32H,22-24H2,1-3H3
InChIKeyLDOVSBOGZLOTHZ-UHFFFAOYSA-N
MW482.70 g/mol
LogP5.83
Rot. Bonds9

About [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol

[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol (PubChem CID 69313641) has the molecular formula C31H34O3Si and a molecular weight of 482.70 g/mol. Its IUPAC name is [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol.

Molecular Properties

Compound Name[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol
PubChem CID69313641
Molecular FormulaC31H34O3Si
Molecular Weight482.70 g/mol
Exact Mass482.23
IUPAC Name[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol
SMILESCC(C)(C)[Si](OCc1cc(CO)cc(OCc2ccccc2)c1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H34O3Si/c1-31(2,3)35(29-15-9-5-10-16-29,30-17-11-6-12-18-30)34-24-27-19-26(22-32)20-28(21-27)33-23-25-13-7-4-8-14-25/h4-21,32H,22-24H2,1-3H3
InChIKeyLDOVSBOGZLOTHZ-UHFFFAOYSA-N
XLogP5.83
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.70
LogP ≤ 55.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methanol
CID 15385707
3-[[3-[[3-[[3-(hydroxymethyl)-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenoxy]methyl]-5-phenylmethoxyphenol
CID 101175071
tert-butyl-[(4-tert-butylphenyl)methoxy]-diphenylsilane
CID 135028969
(2-bromo-4-pyridinyl)methoxy-tert-butyl-diphenylsilane
CID 10670102
4-[[tert-butyl(diphenyl)silyl]oxymethyl]pyridin-2-amine
CID 59295334
N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-N-methyl-3-phenylmethoxyaniline
CID 153411901
[4-[(2S)-1-[tert-butyl(diphenyl)silyl]oxypropan-2-yl]phenyl]methanol
CID 54762237
[3-[[3,5-bis[[3,5-bis(hydroxymethyl)phenyl]methoxy]phenoxy]methyl]-5-(hydroxymethyl)phenyl]methanol
CID 101251807
5-[[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methoxy-5-phenylmethoxyphenyl]methyl]-2-iodo-4-phenylmethoxyphenol
CID 10843132
5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methoxyphenol
CID 11269381
4-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methoxyphenol
CID 11486184
methyl 3-(hydroxymethyl)-5-phenylmethoxybenzoate
CID 24813623

Frequently Asked Questions

What is the IUPAC name of [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol?
The IUPAC name of [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol (CID 69313641) is [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol.
What is the SMILES notation for [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol?
The canonical SMILES for [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol is CC(C)(C)[Si](OCc1cc(CO)cc(OCc2ccccc2)c1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol?
The InChIKey is LDOVSBOGZLOTHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H34O3Si/c1-31(2,3)35(29-15-9-5-10-16-29,30-17-11-6-12-18-30)34-24-27-19-26(22-32)20-28(21-27)33-23-25-13-7-4-8-14-25/h4-21,32H,22-24H2,1-3H3.
What are the key properties of [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol?
[3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol has a molecular weight of 482.70 g/mol, XLogP of 5.83, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[tert-butyl(diphenyl)silyl]oxymethyl]-5-phenylmethoxyphenyl]methanol is sourced from PubChem (CID 69313641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).