[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol

C30H32O2Si — CID 102217007

IUPAC[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol
SMILESCC(C)(C)[Si](OCc1ccccc1C(O)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H32O2Si/c1-30(2,3)33(26-18-9-5-10-19-26,27-20-11-6-12-21-27)32-23-25-17-13-14-22-28(25)29(31)24-15-7-4-8-16-24/h4-22,29,31H,23H2,1-3H3
InChIKeyICDXBQAIXNCDDJ-UHFFFAOYSA-N
MW452.67 g/mol
LogP5.84
Rot. Bonds7

About [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol

[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol (PubChem CID 102217007) has the molecular formula C30H32O2Si and a molecular weight of 452.67 g/mol. Its IUPAC name is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol.

Molecular Properties

Compound Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol
PubChem CID102217007
Molecular FormulaC30H32O2Si
Molecular Weight452.67 g/mol
Exact Mass452.22
IUPAC Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol
SMILESCC(C)(C)[Si](OCc1ccccc1C(O)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H32O2Si/c1-30(2,3)33(26-18-9-5-10-19-26,27-20-11-6-12-21-27)32-23-25-17-13-14-22-28(25)29(31)24-15-7-4-8-16-24/h4-22,29,31H,23H2,1-3H3
InChIKeyICDXBQAIXNCDDJ-UHFFFAOYSA-N
XLogP5.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.67
LogP ≤ 55.84
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

(2R,5R)-1,6-bis[[tert-butyl(diphenyl)silyl]oxy]hexane-2,5-diol
CID 10746539
(2R)-1-[tert-butyl(diphenyl)silyl]oxy-3-sulfanylpropan-2-ol
CID 15451317
[tert-butyl(diphenyl)silyl] 2-[[tert-butyl(diphenyl)silyl]oxymethyl]benzoate
CID 11169578
3-[[tert-butyl(diphenyl)silyl]oxymethyl]-1H-pyridin-2-one
CID 59410156
2-bromo-6-[[tert-butyl(diphenyl)silyl]oxymethyl]aniline
CID 153278666
(2R)-1-[tert-butyl(diphenyl)silyl]oxy-3-chloropropan-2-ol
CID 124630717
1-[tert-butyl(diphenyl)silyl]oxy-3-methoxypropan-2-ol
CID 172588590
3-[tert-butyl(diphenyl)silyl]oxy-2-phenylpropanoic acid
CID 168947861
(E,2R)-5-[tert-butyl(diphenyl)silyl]oxypent-3-en-2-ol
CID 25223642
(E,1R,4R,5R,6S)-7-[tert-butyl(diphenyl)silyl]oxy-4,6-dimethyl-1-phenylhept-2-ene-1,5-diol
CID 71490044
tert-butyl-[(4-tert-butylphenyl)methoxy]-diphenylsilane
CID 135028969
(E,2S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]pent-3-en-2-ol
CID 44542246

Frequently Asked Questions

What is the IUPAC name of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol?
The IUPAC name of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol (CID 102217007) is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol.
What is the SMILES notation for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol?
The canonical SMILES for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol is CC(C)(C)[Si](OCc1ccccc1C(O)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol?
The InChIKey is ICDXBQAIXNCDDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32O2Si/c1-30(2,3)33(26-18-9-5-10-19-26,27-20-11-6-12-21-27)32-23-25-17-13-14-22-28(25)29(31)24-15-7-4-8-16-24/h4-22,29,31H,23H2,1-3H3.
What are the key properties of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol?
[2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol has a molecular weight of 452.67 g/mol, XLogP of 5.84, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]phenyl]-phenylmethanol is sourced from PubChem (CID 102217007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).