[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol

C23H32O3Si — CID 16736190

IUPAC[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol
SMILESCC(C)(C)[Si](OC[C@H]1CC[C@](C)(CO)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H32O3Si/c1-22(2,3)27(20-11-7-5-8-12-20,21-13-9-6-10-14-21)25-17-19-15-16-23(4,18-24)26-19/h5-14,19,24H,15-18H2,1-4H3/t19-,23-/m1/s1
InChIKeyJTSBJNSQGJGBMN-AUSIDOKSSA-N
MW384.59 g/mol
LogP3.49
Rot. Bonds6

About [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol

[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol (PubChem CID 16736190) has the molecular formula C23H32O3Si and a molecular weight of 384.59 g/mol. Its IUPAC name is [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol
PubChem CID16736190
Molecular FormulaC23H32O3Si
Molecular Weight384.59 g/mol
Exact Mass384.21
IUPAC Name[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol
SMILESCC(C)(C)[Si](OC[C@H]1CC[C@](C)(CO)O1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H32O3Si/c1-22(2,3)27(20-11-7-5-8-12-20,21-13-9-6-10-14-21)25-17-19-15-16-23(4,18-24)26-19/h5-14,19,24H,15-18H2,1-4H3/t19-,23-/m1/s1
InChIKeyJTSBJNSQGJGBMN-AUSIDOKSSA-N
XLogP3.49
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.59
LogP ≤ 53.49
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

[(2R,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]methanol
CID 10981523
[(3R,5S,7S,9S)-9-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-methyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-3-yl]methanol
CID 10815891
(4R)-3-[(2R)-3-[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]-2-methylpropanoyl]-4-propan-2-yl-1,3-oxazolidin-2-one
CID 16736204
(5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,4-dioxan-2-ol
CID 162409626
tert-butyl-[[(2S)-oxolan-2-yl]methoxy]-diphenylsilane
CID 56616386
[(4R,5R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]-2,2,5-trimethyl-1,3-dioxan-4-yl]methanol
CID 102393035
(3R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]oxan-3-amine
CID 142544481
[(1R,3S)-3-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,2,2-trimethylcyclopentyl]methanol
CID 15443826
(3R,6S)-3-amino-6-[[tert-butyl(diphenyl)silyl]oxymethyl]oxane-3-carbonitrile
CID 66588772
(2R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolane-2-carboxylic acid
CID 66663469
(2R)-4-[(4R,6S)-6-[[tert-butyl(diphenyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxan-4-yl]-2-methylbutan-1-ol
CID 42600017
(2S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutan-1-ol
CID 174251063

Frequently Asked Questions

What is the IUPAC name of [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol?
The IUPAC name of [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol (CID 16736190) is [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol.
What is the SMILES notation for [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol?
The canonical SMILES for [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol is CC(C)(C)[Si](OC[C@H]1CC[C@](C)(CO)O1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol?
The InChIKey is JTSBJNSQGJGBMN-AUSIDOKSSA-N. The full InChI is InChI=1S/C23H32O3Si/c1-22(2,3)27(20-11-7-5-8-12-20,21-13-9-6-10-14-21)25-17-19-15-16-23(4,18-24)26-19/h5-14,19,24H,15-18H2,1-4H3/t19-,23-/m1/s1.
What are the key properties of [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol?
[(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol has a molecular weight of 384.59 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-2-methyloxolan-2-yl]methanol is sourced from PubChem (CID 16736190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).