(1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane

C10H20O2Si — CID 72760632

IUPAC(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
InChIKeyMCPRJMDLBNVXPR-UHFFFAOYSA-N
MW200.35 g/mol
LogP3.29
Rot. Bonds5

About (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane

(1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane (PubChem CID 72760632) has the molecular formula C10H20O2Si and a molecular weight of 200.35 g/mol. Its IUPAC name is (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane.

Molecular Properties

Compound Name(1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane
PubChem CID72760632
Molecular FormulaC10H20O2Si
Molecular Weight200.35 g/mol
Exact Mass200.12
IUPAC Name(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
InChIKeyMCPRJMDLBNVXPR-UHFFFAOYSA-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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Related Compounds

tert-butyl-[(1Z)-1-ethoxybuta-1,3-dienoxy]-dimethylsilane
CID 11042502
[(1-Ethoxy-2-ethyl-1-buten-1-yl)oxy]trimethylsilane
CID 12809188
[(E)-1-ethoxy-3-methylbut-1-enoxy]-trimethylsilane
CID 12959692
tert-butyl-[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-dimethylsilane
CID 11521586
[(1Z,3E)-1,4-dimethoxy-2-methylbuta-1,3-dienoxy]-trimethylsilane
CID 134876412
[(3E)-4-methoxy-3-methylbuta-1,3-dien-2-yl]oxy-trimethylsilane
CID 10899374
[(1Z)-1-methoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane
CID 10932163
[(1Z)-1-ethoxybuta-1,3-dienoxy]-trimethylsilane
CID 11148143
[(1Z)-1-ethoxy-3-methylbuta-1,3-dienoxy]-trimethylsilane
CID 11229420
[(1E)-1-ethoxybuta-1,3-dienoxy]-trimethylsilane
CID 12545296
[(4-Methoxy-3-methylbuta-1,3-dien-2-yl)oxy](trimethyl)silane
CID 54308306
[(Z)-1-ethoxyhex-1-enoxy]-trimethylsilane
CID 88470139

Frequently Asked Questions

What is the IUPAC name of (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane?
The IUPAC name of (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane (CID 72760632) is (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane.
What is the SMILES notation for (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane?
The canonical SMILES for (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 (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane?
The InChIKey is MCPRJMDLBNVXPR-UHFFFAOYSA-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.
What are the key properties of (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane?
(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 (1-ethoxy-3-methylbuta-1,3-dienoxy)-trimethylsilane is sourced from PubChem (CID 72760632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).