hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane

C20H34O4Si — CID 101497939

IUPAChydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane
SMILESCC(C)(C)O[Si](O)(OC(C)(C)C)[C@@H]1C[C@H]1CCOCc1ccccc1
InChIInChI=1S/C20H34O4Si/c1-19(2,3)23-25(21,24-20(4,5)6)18-14-17(18)12-13-22-15-16-10-8-7-9-11-16/h7-11,17-18,21H,12-15H2,1-6H3/t17-,18-/m1/s1
InChIKeyHGFNICPTKZDABT-QZTJIDSGSA-N
MW366.57 g/mol
LogP4.54
Rot. Bonds8

About hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane

hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane (PubChem CID 101497939) has the molecular formula C20H34O4Si and a molecular weight of 366.57 g/mol. Its IUPAC name is hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane.

Molecular Properties

Compound Namehydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane
PubChem CID101497939
Molecular FormulaC20H34O4Si
Molecular Weight366.57 g/mol
Exact Mass366.22
IUPAC Namehydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane
SMILESCC(C)(C)O[Si](O)(OC(C)(C)C)[C@@H]1C[C@H]1CCOCc1ccccc1
InChIInChI=1S/C20H34O4Si/c1-19(2,3)23-25(21,24-20(4,5)6)18-14-17(18)12-13-22-15-16-10-8-7-9-11-16/h7-11,17-18,21H,12-15H2,1-6H3/t17-,18-/m1/s1
InChIKeyHGFNICPTKZDABT-QZTJIDSGSA-N
XLogP4.54
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.57
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(1R)-2-methylcyclopropyl]ethoxymethylbenzene
CID 158778090
[(1R,2R)-2-tert-butylcyclopropyl]methoxymethylbenzene
CID 10878630
2-(2-phenylmethoxyethyl)oxolane;propane-2,2-diol
CID 156747530
4-chloro-3-(2-phenylmethoxyethyl)oxane
CID 130537120
N'-ethyl-N-methyl-N'-[[2-methyl-3-(2-phenylmethoxyethyl)cyclobutyl]methyl]ethane-1,2-diamine
CID 129015804
cis-tert-butyl (1S,2S)-2-(phenylmethoxymethyl)cyclopropane-1-carboxylate
CID 163289434
2-[2-[(1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrakis(phenylmethoxy)-6-[2-(2-phenylmethoxyethoxy)ethoxy]cyclohexyl]oxyethoxy]ethoxymethylbenzene
CID 10941970
tert-butyl-[(1R,2R,4S,5S)-5-ethenyl-5-methyl-2-(2-phenylmethoxyethyl)-4-prop-1-en-2-ylcyclohexyl]oxy-dimethylsilane
CID 11212530
2-methyl-6-phenylmethoxyhexan-2-ol
CID 130681536
2,2-dimethyl-5-(2-phenylmethoxyethyl)-1,3-dioxane
CID 85248081
tert-butyl N-[(2R,3R)-2-(2-phenylmethoxyethyl)oxolan-3-yl]carbamate;ethane
CID 143391209
(1S,7S,8R,8aR)-7-(2-phenylmethoxyethyl)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2,8-triol
CID 59100041

Frequently Asked Questions

What is the IUPAC name of hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane?
The IUPAC name of hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane (CID 101497939) is hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane.
What is the SMILES notation for hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane?
The canonical SMILES for hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane is CC(C)(C)O[Si](O)(OC(C)(C)C)[C@@H]1C[C@H]1CCOCc1ccccc1.
What is the InChIKey of hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane?
The InChIKey is HGFNICPTKZDABT-QZTJIDSGSA-N. The full InChI is InChI=1S/C20H34O4Si/c1-19(2,3)23-25(21,24-20(4,5)6)18-14-17(18)12-13-22-15-16-10-8-7-9-11-16/h7-11,17-18,21H,12-15H2,1-6H3/t17-,18-/m1/s1.
What are the key properties of hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane?
hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane has a molecular weight of 366.57 g/mol, XLogP of 4.54, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-bis[(2-methylpropan-2-yl)oxy]-[(1R,2R)-2-(2-phenylmethoxyethyl)cyclopropyl]silane is sourced from PubChem (CID 101497939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).