tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane

C19H46OSi4 — CID 73443150

IUPACtert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane
SMILESCC(C)(C)[Si](C)(C)OC=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C19H46OSi4/c1-18(2,3)24(13,14)20-17-15-16-19(21(4,5)6,22(7,8)9)23(10,11)12/h15,17H,16H2,1-14H3
InChIKeyKDJHUMQXUAPDAK-UHFFFAOYSA-N
MW402.92 g/mol
LogP7.75
Rot. Bonds7

About tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane

tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane (PubChem CID 73443150) has the molecular formula C19H46OSi4 and a molecular weight of 402.92 g/mol. Its IUPAC name is tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane
PubChem CID73443150
Molecular FormulaC19H46OSi4
Molecular Weight402.92 g/mol
Exact Mass402.26
IUPAC Nametert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane
SMILESCC(C)(C)[Si](C)(C)OC=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C19H46OSi4/c1-18(2,3)24(13,14)20-17-15-16-19(21(4,5)6,22(7,8)9)23(10,11)12/h15,17H,16H2,1-14H3
InChIKeyKDJHUMQXUAPDAK-UHFFFAOYSA-N
XLogP7.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.92
LogP ≤ 57.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-(4-methoxybuta-1,3-dienoxy)-dimethylsilane
CID 173308840
tert-butyl-dimethyl-[(1Z,3E)-octa-1,3-dienoxy]silane
CID 11615647
(Z)-2-[tert-butyl(dimethyl)silyl]oxy-N,N-dimethylethenamine
CID 59793232
1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane
CID 12727914
1-[(1E,4E)-5-[tert-butyl(dimethyl)silyl]oxypenta-1,4-dienyl]cyclohexan-1-ol
CID 11208694
tert-butyl-dimethyl-[(E)-3,4,4-trimethylpent-1-enoxy]silane
CID 101149922
2-[4-[tert-butyl(dimethyl)silyl]oxybut-3-enyl]benzonitrile
CID 70239457
tert-butyl-dimethyl-[(1E,3Z)-3-trimethylsilyloxypenta-1,3-dienoxy]silane
CID 101185110
tert-butyl (E)-3-[tert-butyl(dimethyl)silyl]oxyprop-2-enoate
CID 102348097
tert-butyl-dimethyl-(2-phenylethenoxy)silane
CID 10466833
tert-butyl-dimethyl-(2-phenylmethoxyethenoxy)silane
CID 10468367
tert-butyl-dimethyl-[(1E,3E)-4-morpholin-4-ylbuta-1,3-dienoxy]silane
CID 101391276

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane (CID 73443150) is tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane is CC(C)(C)[Si](C)(C)OC=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane?
The InChIKey is KDJHUMQXUAPDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H46OSi4/c1-18(2,3)24(13,14)20-17-15-16-19(21(4,5)6,22(7,8)9)23(10,11)12/h15,17H,16H2,1-14H3.
What are the key properties of tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane?
tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane has a molecular weight of 402.92 g/mol, XLogP of 7.75, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[4,4,4-tris(trimethylsilyl)but-1-enoxy]silane is sourced from PubChem (CID 73443150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).