[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane

C10H20O2Si — CID 11229420

IUPAC[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane
SMILESC=C(C)/C=C(/OCC)O[Si](C)(C)C
InChIInChI=1S/C10H20O2Si/c1-7-11-10(8-9(2)3)12-13(4,5)6/h8H,2,7H2,1,3-6H3/b10-8-
InChIKeyMCPRJMDLBNVXPR-NTMALXAHSA-N
MW200.35 g/mol
LogP3.29
Rot. Bonds5

About [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane

[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane (PubChem CID 11229420) has the molecular formula C10H20O2Si and a molecular weight of 200.35 g/mol. Its IUPAC name is [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane
PubChem CID11229420
Molecular FormulaC10H20O2Si
Molecular Weight200.35 g/mol
Exact Mass200.12
IUPAC Name[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane
SMILESC=C(C)/C=C(/OCC)O[Si](C)(C)C
InChIInChI=1S/C10H20O2Si/c1-7-11-10(8-9(2)3)12-13(4,5)6/h8H,2,7H2,1,3-6H3/b10-8-
InChIKeyMCPRJMDLBNVXPR-NTMALXAHSA-N
XLogP3.29
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 53.29
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane?
The IUPAC name of [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane (CID 11229420) is [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane.
What is the SMILES notation for [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane?
The canonical SMILES for [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane is C=C(C)/C=C(/OCC)O[Si](C)(C)C.
What is the InChIKey of [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane?
The InChIKey is MCPRJMDLBNVXPR-NTMALXAHSA-N. The full InChI is InChI=1S/C10H20O2Si/c1-7-11-10(8-9(2)3)12-13(4,5)6/h8H,2,7H2,1,3-6H3/b10-8-.
What are the key properties of [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane?
[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane has a molecular weight of 200.35 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane is sourced from PubChem (CID 11229420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).