[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane

C21H48O2Si3 — CID 11165972

IUPAC[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane
SMILESC=C(C[C@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C21H48O2Si3/c1-18(17-24(8,9)10)15-19(23-26(13,14)21(5,6)7)16-22-25(11,12)20(2,3)4/h19H,1,15-17H2,2-14H3/t19-/m1/s1
InChIKeyLGQDXSOAULISAR-LJQANCHMSA-N
MW416.87 g/mol
LogP7.68
Rot. Bonds9

About [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane

[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane (PubChem CID 11165972) has the molecular formula C21H48O2Si3 and a molecular weight of 416.87 g/mol. Its IUPAC name is [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane.

Molecular Properties

Compound Name[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane
PubChem CID11165972
Molecular FormulaC21H48O2Si3
Molecular Weight416.87 g/mol
Exact Mass416.30
IUPAC Name[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane
SMILESC=C(C[C@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C21H48O2Si3/c1-18(17-24(8,9)10)15-19(23-26(13,14)21(5,6)7)16-22-25(11,12)20(2,3)4/h19H,1,15-17H2,2-14H3/t19-/m1/s1
InChIKeyLGQDXSOAULISAR-LJQANCHMSA-N
XLogP7.68
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.87
LogP ≤ 57.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(S)-1,3-Di-[(tert-butyldimethylsilyloxy)]-4-methyl-4-pentene
CID 11336893
tert-butyl-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypent-4-enoxy]-dimethylsilane
CID 11336491
tert-butyl-[(4R,5R)-5-[tert-butyl(dimethyl)silyl]oxyocta-1,7-dien-4-yl]oxy-dimethylsilane
CID 15416504
tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane
CID 16726469
triethyl-[(3S)-5-methyl-2-trimethylsilyloxyhex-1-en-3-yl]oxysilane
CID 134846128
tert-butyl-[(3S)-3-[tert-butyl(dimethyl)silyl]oxyhex-5-enoxy]-dimethylsilane
CID 134940445
tert-butyl-[(4S,5S)-5-[tert-butyl(dimethyl)silyl]oxyocta-1,7-dien-4-yl]oxy-dimethylsilane
CID 135072554
tert-butyl-[(2R,3R)-2-[tert-butyl(dimethyl)silyl]oxyhex-5-en-3-yl]oxy-dimethylsilane
CID 139249864
tert-butyl-[(1S)-1-[(1S)-1-[tert-butyl(dimethyl)silyl]oxybut-3-enyl]hept-2-ynoxy]-dimethylsilane
CID 10919553
tert-butyl-dimethyl-[(2S)-4-trimethylsilyloxypent-4-en-2-yl]oxysilane
CID 12156208
Tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxy-3-methylidenepentoxy]-dimethylsilane
CID 13838141
Tert-butyl-[3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]penta-3,4-dienoxy]-dimethylsilane
CID 13838143

Frequently Asked Questions

What is the IUPAC name of [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane?
The IUPAC name of [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane (CID 11165972) is [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane.
What is the SMILES notation for [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane?
The canonical SMILES for [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane is C=C(C[C@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C[Si](C)(C)C.
What is the InChIKey of [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane?
The InChIKey is LGQDXSOAULISAR-LJQANCHMSA-N. The full InChI is InChI=1S/C21H48O2Si3/c1-18(17-24(8,9)10)15-19(23-26(13,14)21(5,6)7)16-22-25(11,12)20(2,3)4/h19H,1,15-17H2,2-14H3/t19-/m1/s1.
What are the key properties of [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane?
[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane has a molecular weight of 416.87 g/mol, XLogP of 7.68, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane is sourced from PubChem (CID 11165972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).