dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane

C13H28O2Si — CID 91698385

IUPACdimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane
SMILESC=CCC(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-7-9-13(4)15-16(5,6)14-11-8-10-12(2)3/h7,12-13H,1,8-11H2,2-6H3
InChIKeySLOSVMPPYJRQCW-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.12
Rot. Bonds9

About dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane

dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane (PubChem CID 91698385) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane.

Molecular Properties

Compound Namedimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane
PubChem CID91698385
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Namedimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane
SMILESC=CCC(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-7-9-13(4)15-16(5,6)14-11-8-10-12(2)3/h7,12-13H,1,8-11H2,2-6H3
InChIKeySLOSVMPPYJRQCW-UHFFFAOYSA-N
XLogP4.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane?
The IUPAC name of dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane (CID 91698385) is dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane.
What is the SMILES notation for dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane?
The canonical SMILES for dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane is C=CCC(C)O[Si](C)(C)OCCCC(C)C.
What is the InChIKey of dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane?
The InChIKey is SLOSVMPPYJRQCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-7-9-13(4)15-16(5,6)14-11-8-10-12(2)3/h7,12-13H,1,8-11H2,2-6H3.
What are the key properties of dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane?
dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane has a molecular weight of 244.45 g/mol, XLogP of 4.12, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(4-methylpentoxy)-pent-4-en-2-yloxysilane is sourced from PubChem (CID 91698385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).