tert-butyl-pentan-3-yloxy-diphenylsilane

C21H30OSi — CID 58776136

IUPACtert-butyl-pentan-3-yloxy-diphenylsilane
SMILESCCC(CC)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H30OSi/c1-6-18(7-2)22-23(21(3,4)5,19-14-10-8-11-15-19)20-16-12-9-13-17-20/h8-18H,6-7H2,1-5H3
InChIKeyIXHIUSZRBPNXLS-UHFFFAOYSA-N
MW326.56 g/mol
LogP4.75
Rot. Bonds6

About tert-butyl-pentan-3-yloxy-diphenylsilane

tert-butyl-pentan-3-yloxy-diphenylsilane (PubChem CID 58776136) has the molecular formula C21H30OSi and a molecular weight of 326.56 g/mol. Its IUPAC name is tert-butyl-pentan-3-yloxy-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-pentan-3-yloxy-diphenylsilane
PubChem CID58776136
Molecular FormulaC21H30OSi
Molecular Weight326.56 g/mol
Exact Mass326.21
IUPAC Nametert-butyl-pentan-3-yloxy-diphenylsilane
SMILESCCC(CC)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H30OSi/c1-6-18(7-2)22-23(21(3,4)5,19-14-10-8-11-15-19)20-16-12-9-13-17-20/h8-18H,6-7H2,1-5H3
InChIKeyIXHIUSZRBPNXLS-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.56
LogP ≤ 54.75
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-(1-iodopentan-3-yloxy)-diphenylsilane
CID 11080903
tert-butyl-[(2Z,7Z)-nona-2,7-dien-5-yl]oxy-diphenylsilane
CID 58139640
tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
CID 11028852
(Z)-18-[tert-butyl(diphenyl)silyl]oxyicos-14-en-1-ol
CID 153316540
tert-butyl-[(2R)-hexan-2-yl]oxy-diphenylsilane
CID 134846417
dimethyl-pentan-3-yloxy-phenylsilane
CID 11345091
tert-butyl-[(Z)-heptacos-19-en-10-yl]oxy-diphenylsilane
CID 140673619
tert-butyl-[(2R,4R)-1-iodo-2,6-dimethylheptan-4-yl]oxy-diphenylsilane
CID 25001335
(3S)-3-[tert-butyl(diphenyl)silyl]oxypentane-1,4-diol
CID 15409689
tert-butyl-diphenyl-tetradecan-2-yloxysilane
CID 71344239
10-[tert-butyl(diphenyl)silyl]oxynonadecanoic acid
CID 123768020
1,7-bis(4-bromophenyl)heptan-4-yloxy-tert-butyl-diphenylsilane
CID 19825362

Frequently Asked Questions

What is the IUPAC name of tert-butyl-pentan-3-yloxy-diphenylsilane?
The IUPAC name of tert-butyl-pentan-3-yloxy-diphenylsilane (CID 58776136) is tert-butyl-pentan-3-yloxy-diphenylsilane.
What is the SMILES notation for tert-butyl-pentan-3-yloxy-diphenylsilane?
The canonical SMILES for tert-butyl-pentan-3-yloxy-diphenylsilane is CCC(CC)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-pentan-3-yloxy-diphenylsilane?
The InChIKey is IXHIUSZRBPNXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30OSi/c1-6-18(7-2)22-23(21(3,4)5,19-14-10-8-11-15-19)20-16-12-9-13-17-20/h8-18H,6-7H2,1-5H3.
What are the key properties of tert-butyl-pentan-3-yloxy-diphenylsilane?
tert-butyl-pentan-3-yloxy-diphenylsilane has a molecular weight of 326.56 g/mol, XLogP of 4.75, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-pentan-3-yloxy-diphenylsilane is sourced from PubChem (CID 58776136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).