dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane

C13H28O2Si — CID 91698239

IUPACdimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane
SMILESC=C(C)CCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2)8-7-10-14-16(5,6)15-11-9-13(3)4/h12H,3,7-11H2,1-2,4-6H3
InChIKeyZBCVDEBLOWVIOG-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.12
Rot. Bonds9

About dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane

dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane (PubChem CID 91698239) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane.

Molecular Properties

Compound Namedimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane
PubChem CID91698239
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Namedimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane
SMILESC=C(C)CCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2)8-7-10-14-16(5,6)15-11-9-13(3)4/h12H,3,7-11H2,1-2,4-6H3
InChIKeyZBCVDEBLOWVIOG-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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Related Compounds

Silane, dimethyl(but-3-enyloxy)isohexyloxy-
CID 91698242
Silane, dimethyl(pent-4-en-2-yloxy)isohexyloxy-
CID 91698385
Dimethylpyrrolbis[(3-methylbut-3-en-1-yl)oxy]morphosilane
CID 91717992
Silane, dimethyl(3-methylbut-3-enyloxy)propoxy-
CID 91719387
Silane, dimethyl(3-methylbut-3-enyloxy)isobutoxy-
CID 91723647
Silane, dimethyl(3-methylbut-3-enyloxy)butoxy-
CID 91723701
Silane, dimethyl(3-methylbut-3-enyloxy)pentyloxy-
CID 91726713
Silane, dimethyl(3-methylbut-3-enyloxy)hexyloxy-
CID 91730344
Silane, dimethyl(dimethyl(but-3-enyloxy)silyloxy)isohexyloxy-
CID 91736917
Tert-butyl-(2,3-dimethylbut-3-enoxy)-dimethylsilane
CID 101379258
tert-butyl-[(2R)-2,3-dimethylbut-3-enoxy]-dimethylsilane
CID 146163907
tert-butyl-[(2R)-2,4-dimethylpent-4-enoxy]-dimethylsilane
CID 9991390

Frequently Asked Questions

What is the IUPAC name of dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane?
The IUPAC name of dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane (CID 91698239) is dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane.
What is the SMILES notation for dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane?
The canonical SMILES for dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane is C=C(C)CCO[Si](C)(C)OCCCC(C)C.
What is the InChIKey of dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane?
The InChIKey is ZBCVDEBLOWVIOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-12(2)8-7-10-14-16(5,6)15-11-9-13(3)4/h12H,3,7-11H2,1-2,4-6H3.
What are the key properties of dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane?
dimethyl-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane 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-(3-methylbut-3-enoxy)-(4-methylpentoxy)silane is sourced from PubChem (CID 91698239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).