tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane

C19H40O2Si2 — CID 10570287

IUPACtert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane
SMILESC#CC[C@](C)(CCO[Si](C)(C)C(C)(C)C)O[Si](CC)(CC)CC
InChIInChI=1S/C19H40O2Si2/c1-11-15-19(8,21-23(12-2,13-3)14-4)16-17-20-22(9,10)18(5,6)7/h1H,12-17H2,2-10H3/t19-/m1/s1
InChIKeyBRIBJSJOCKXBJO-LJQANCHMSA-N
MW356.70 g/mol
LogP6.20
Rot. Bonds10

About tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane

tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane (PubChem CID 10570287) has the molecular formula C19H40O2Si2 and a molecular weight of 356.70 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane
PubChem CID10570287
Molecular FormulaC19H40O2Si2
Molecular Weight356.70 g/mol
Exact Mass356.26
IUPAC Nametert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane
SMILESC#CC[C@](C)(CCO[Si](C)(C)C(C)(C)C)O[Si](CC)(CC)CC
InChIInChI=1S/C19H40O2Si2/c1-11-15-19(8,21-23(12-2,13-3)14-4)16-17-20-22(9,10)18(5,6)7/h1H,12-17H2,2-10H3/t19-/m1/s1
InChIKeyBRIBJSJOCKXBJO-LJQANCHMSA-N
XLogP6.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.70
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-(2-triethylsilyloxyethoxy)silane
CID 16742633
tert-butyl-dimethyl-[(3R,4S)-4-methyl-3-triethylsilyloxyhex-5-ynoxy]silane
CID 11602878
tert-butyl-hexadec-15-ynoxy-dimethylsilane
CID 23073442
1-[tert-butyl(dimethyl)silyl]oxy-3-methylpentan-3-ol
CID 142478700
tert-butyl-[(2S)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]but-3-ynoxy]-dimethylsilane
CID 56850000
tert-butyl-(3-ethynoxypropoxy)-dimethylsilane
CID 176737355
(1-cyclopropyl-3-methylhex-5-yn-3-yl)oxy-trimethylsilane
CID 13387951
tert-butyl-[(3S,4R)-3-[tert-butyl(dimethyl)silyl]oxy-4-methylhept-6-ynoxy]-dimethylsilane
CID 11773114
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-hex-5-ynoxy-dimethylsilane;hex-5-yn-1-ol
CID 158514976

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane (CID 10570287) is tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane is C#CC[C@](C)(CCO[Si](C)(C)C(C)(C)C)O[Si](CC)(CC)CC.
What is the InChIKey of tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane?
The InChIKey is BRIBJSJOCKXBJO-LJQANCHMSA-N. The full InChI is InChI=1S/C19H40O2Si2/c1-11-15-19(8,21-23(12-2,13-3)14-4)16-17-20-22(9,10)18(5,6)7/h1H,12-17H2,2-10H3/t19-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane?
tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane has a molecular weight of 356.70 g/mol, XLogP of 6.20, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(3R)-3-methyl-3-triethylsilyloxyhex-5-ynoxy]silane is sourced from PubChem (CID 10570287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).