tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane

C22H32OSi — CID 134846417

IUPACtert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane
SMILESCCCC[C@@H](C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C22H32OSi/c1-6-7-14-19(2)23-24(22(3,4)5,20-15-10-8-11-16-20)21-17-12-9-13-18-21/h8-13,15-19H,6-7,14H2,1-5H3/t19-/m1/s1
InChIKeyWLVGAKZQQXQCMU-LJQANCHMSA-N
MW340.58 g/mol
LogP5.14
Rot. Bonds7

About tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane

tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane (PubChem CID 134846417) has the molecular formula C22H32OSi and a molecular weight of 340.58 g/mol. Its IUPAC name is tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane
PubChem CID134846417
Molecular FormulaC22H32OSi
Molecular Weight340.58 g/mol
Exact Mass340.22
IUPAC Nametert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane
SMILESCCCC[C@@H](C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C22H32OSi/c1-6-7-14-19(2)23-24(22(3,4)5,20-15-10-8-11-16-20)21-17-12-9-13-18-21/h8-13,15-19H,6-7,14H2,1-5H3/t19-/m1/s1
InChIKeyWLVGAKZQQXQCMU-LJQANCHMSA-N
XLogP5.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.58
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-diphenyl-tetradecan-2-yloxysilane
CID 71344239
tert-butyl-[(2S)-5-iodopentan-2-yl]oxy-diphenylsilane
CID 122389486
tert-butyl-[(2R,5S)-5-butylsulfanylhexan-2-yl]oxy-diphenylsilane
CID 134846418
[(5S)-5-[tert-butyl(diphenyl)silyl]oxyhexyl]-triphenylphosphanium bromide
CID 11802691
(5S)-5-[tert-butyl(diphenyl)silyl]oxyhexanal
CID 24755231
(4S)-4-[tert-butyl(diphenyl)silyl]oxypentane-1-sulfonic acid
CID 172708913
tert-butyl-diphenyl-[(2S)-undec-10-en-2-yl]oxysilane
CID 11988597
(3R)-3-[tert-butyl(diphenyl)silyl]oxyoctan-2-ol
CID 58876341
(17S)-17-[tert-butyl(diphenyl)silyl]oxyoctadeca-4,12-diyn-1-ol
CID 153316530
(Z)-19-[tert-butyl(diphenyl)silyl]oxyicos-5-en-1-ol
CID 153316559
(E,7R)-7-[tert-butyl(diphenyl)silyl]oxy-2-methyloct-2-en-1-ol
CID 16754110
(10R)-10-[tert-butyl(diphenyl)silyl]oxyundec-1-en-6-ol
CID 134834787

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane?
The IUPAC name of tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane (CID 134846417) is tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane.
What is the SMILES notation for tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane?
The canonical SMILES for tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane is CCCC[C@@H](C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane?
The InChIKey is WLVGAKZQQXQCMU-LJQANCHMSA-N. The full InChI is InChI=1S/C22H32OSi/c1-6-7-14-19(2)23-24(22(3,4)5,20-15-10-8-11-16-20)21-17-12-9-13-18-21/h8-13,15-19H,6-7,14H2,1-5H3/t19-/m1/s1.
What are the key properties of tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane?
tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane has a molecular weight of 340.58 g/mol, XLogP of 5.14, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane is sourced from PubChem (CID 134846417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).