tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane

C16H32OSi — CID 102402000

IUPACtert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane
SMILESCC(=C=CCC(C)C)[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-13(2)11-10-12-14(3)15(4)17-18(8,9)16(5,6)7/h10,13,15H,11H2,1-9H3/t12?,15-/m1/s1
InChIKeyXHDZTTYRVRLKJK-WPZCJLIBSA-N
MW268.52 g/mol
LogP5.54
Rot. Bonds5

About tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane

tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane (PubChem CID 102402000) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane
PubChem CID102402000
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane
SMILESCC(=C=CCC(C)C)[C@@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-13(2)11-10-12-14(3)15(4)17-18(8,9)16(5,6)7/h10,13,15H,11H2,1-9H3/t12?,15-/m1/s1
InChIKeyXHDZTTYRVRLKJK-WPZCJLIBSA-N
XLogP5.54
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.54
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-dimethyl-(3-methylbut-3-en-2-yloxy)silane
CID 15935934
tert-butyl-dimethyl-[(E)-3-methyl-4-trimethylsilyloxybut-3-en-2-yl]oxysilane
CID 101356352
(2R)-2-[tert-butyl(dimethyl)silyl]oxypropanoic acid
CID 14358757
(Z,4R,5R)-5-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylhex-2-en-1-ol
CID 122371218
3-[tert-butyl(dimethyl)silyl]oxybutan-1-ol
CID 554645
4-[tert-butyl(dimethyl)silyl]oxypent-1-en-3-one
CID 553195
1-[tert-butyl(dimethyl)silyl]oxyethanol
CID 22038232
2-[tert-butyl(dimethyl)silyl]oxyhex-4-en-3-one
CID 173049340
(3S)-1,1-dibromo-3-[tert-butyl(dimethyl)silyl]oxybutan-2-one
CID 10970420
(5R,6S,7R,8E)-7-[tert-butyl(dimethyl)silyl]oxy-2,6,8-trimethyldeca-2,8-dien-5-ol
CID 140765683
lithium tert-butyl-[(2S)-but-3-yn-2-yl]oxy-dimethylsilane
CID 10867151
2-[tert-butyl(dimethyl)silyl]oxy-3-methylpentanoic acid
CID 14412199

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane (CID 102402000) is tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane is CC(=C=CCC(C)C)[C@@H](C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane?
The InChIKey is XHDZTTYRVRLKJK-WPZCJLIBSA-N. The full InChI is InChI=1S/C16H32OSi/c1-13(2)11-10-12-14(3)15(4)17-18(8,9)16(5,6)7/h10,13,15H,11H2,1-9H3/t12?,15-/m1/s1.
What are the key properties of tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane?
tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane has a molecular weight of 268.52 g/mol, XLogP of 5.54, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-3,7-dimethylocta-3,4-dien-2-yl]oxy-dimethylsilane is sourced from PubChem (CID 102402000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).