1-methoxyhepta-1,2-dienyl(trimethyl)silane

C11H22OSi — CID 12611133

IUPAC1-methoxyhepta-1,2-dienyl(trimethyl)silane
SMILESCCCCC=C=C(OC)[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-6-7-8-9-10-11(12-2)13(3,4)5/h9H,6-8H2,1-5H3
InChIKeyWHWQZRBIFJWTQH-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.74
Rot. Bonds5

About 1-methoxyhepta-1,2-dienyl(trimethyl)silane

1-methoxyhepta-1,2-dienyl(trimethyl)silane (PubChem CID 12611133) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 1-methoxyhepta-1,2-dienyl(trimethyl)silane.

Molecular Properties

Compound Name1-methoxyhepta-1,2-dienyl(trimethyl)silane
PubChem CID12611133
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name1-methoxyhepta-1,2-dienyl(trimethyl)silane
SMILESCCCCC=C=C(OC)[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-6-7-8-9-10-11(12-2)13(3,4)5/h9H,6-8H2,1-5H3
InChIKeyWHWQZRBIFJWTQH-UHFFFAOYSA-N
XLogP3.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methoxyhepta-1,2-dienyl(trimethyl)silane?
The IUPAC name of 1-methoxyhepta-1,2-dienyl(trimethyl)silane (CID 12611133) is 1-methoxyhepta-1,2-dienyl(trimethyl)silane.
What is the SMILES notation for 1-methoxyhepta-1,2-dienyl(trimethyl)silane?
The canonical SMILES for 1-methoxyhepta-1,2-dienyl(trimethyl)silane is CCCCC=C=C(OC)[Si](C)(C)C.
What is the InChIKey of 1-methoxyhepta-1,2-dienyl(trimethyl)silane?
The InChIKey is WHWQZRBIFJWTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-6-7-8-9-10-11(12-2)13(3,4)5/h9H,6-8H2,1-5H3.
What are the key properties of 1-methoxyhepta-1,2-dienyl(trimethyl)silane?
1-methoxyhepta-1,2-dienyl(trimethyl)silane has a molecular weight of 198.38 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxyhepta-1,2-dienyl(trimethyl)silane is sourced from PubChem (CID 12611133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).