hexa-1,5-dien-2-yloxy(trimethyl)silane

C9H18OSi — CID 12579602

IUPAChexa-1,5-dien-2-yloxy(trimethyl)silane
SMILESC=CCCC(=C)O[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-6-7-8-9(2)10-11(3,4)5/h6H,1-2,7-8H2,3-5H3
InChIKeyPFAGAPWOGPPOMI-UHFFFAOYSA-N
MW170.33 g/mol
LogP3.32
Rot. Bonds5

About hexa-1,5-dien-2-yloxy(trimethyl)silane

hexa-1,5-dien-2-yloxy(trimethyl)silane (PubChem CID 12579602) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is hexa-1,5-dien-2-yloxy(trimethyl)silane.

Molecular Properties

Compound Namehexa-1,5-dien-2-yloxy(trimethyl)silane
PubChem CID12579602
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Namehexa-1,5-dien-2-yloxy(trimethyl)silane
SMILESC=CCCC(=C)O[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-6-7-8-9(2)10-11(3,4)5/h6H,1-2,7-8H2,3-5H3
InChIKeyPFAGAPWOGPPOMI-UHFFFAOYSA-N
XLogP3.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hexa-1,5-dien-2-yloxy(trimethyl)silane?
The IUPAC name of hexa-1,5-dien-2-yloxy(trimethyl)silane (CID 12579602) is hexa-1,5-dien-2-yloxy(trimethyl)silane.
What is the SMILES notation for hexa-1,5-dien-2-yloxy(trimethyl)silane?
The canonical SMILES for hexa-1,5-dien-2-yloxy(trimethyl)silane is C=CCCC(=C)O[Si](C)(C)C.
What is the InChIKey of hexa-1,5-dien-2-yloxy(trimethyl)silane?
The InChIKey is PFAGAPWOGPPOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-6-7-8-9(2)10-11(3,4)5/h6H,1-2,7-8H2,3-5H3.
What are the key properties of hexa-1,5-dien-2-yloxy(trimethyl)silane?
hexa-1,5-dien-2-yloxy(trimethyl)silane has a molecular weight of 170.33 g/mol, XLogP of 3.32, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexa-1,5-dien-2-yloxy(trimethyl)silane is sourced from PubChem (CID 12579602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).