tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane

C18H40O2Si2 — CID 11244870

IUPACtert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane
SMILESCC(C)=C(O[Si](C)(C)C(C)(C)C)[C@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H40O2Si2/c1-14(2)16(20-22(12,13)18(7,8)9)15(3)19-21(10,11)17(4,5)6/h15H,1-13H3/t15-/m0/s1
InChIKeyZHBPTNSMDPIZBX-HNNXBMFYSA-N
MW344.69 g/mol
LogP6.71
Rot. Bonds5

About tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane

tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane (PubChem CID 11244870) has the molecular formula C18H40O2Si2 and a molecular weight of 344.69 g/mol. Its IUPAC name is tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane
PubChem CID11244870
Molecular FormulaC18H40O2Si2
Molecular Weight344.69 g/mol
Exact Mass344.26
IUPAC Nametert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane
SMILESCC(C)=C(O[Si](C)(C)C(C)(C)C)[C@H](C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H40O2Si2/c1-14(2)16(20-22(12,13)18(7,8)9)15(3)19-21(10,11)17(4,5)6/h15H,1-13H3/t15-/m0/s1
InChIKeyZHBPTNSMDPIZBX-HNNXBMFYSA-N
XLogP6.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.69
LogP ≤ 56.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy-tri(propan-2-yl)silane
CID 101411882
tert-butyl-dimethyl-[(Z,2S)-3-trimethylsilyloxypent-3-en-2-yl]oxysilane
CID 11173753
2-[Dimethyl(4-methylpent-3-en-2-yloxy)silyl]ethyl-dimethyl-(4-methylpent-3-en-2-yloxy)silane
CID 101071071
tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane
CID 101411883

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane (CID 11244870) is tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane is CC(C)=C(O[Si](C)(C)C(C)(C)C)[C@H](C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane?
The InChIKey is ZHBPTNSMDPIZBX-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H40O2Si2/c1-14(2)16(20-22(12,13)18(7,8)9)15(3)19-21(10,11)17(4,5)6/h15H,1-13H3/t15-/m0/s1.
What are the key properties of tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane?
tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane has a molecular weight of 344.69 g/mol, XLogP of 6.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane is sourced from PubChem (CID 11244870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).