dimethyl-(3-methylbut-2-enoxy)-octoxysilane

C15H32O2Si — CID 91739054

IUPACdimethyl-(3-methylbut-2-enoxy)-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)OCC=C(C)C
InChIInChI=1S/C15H32O2Si/c1-6-7-8-9-10-11-13-16-18(4,5)17-14-12-15(2)3/h12H,6-11,13-14H2,1-5H3
InChIKeyUMAQUABZVBMMSY-UHFFFAOYSA-N
MW272.50 g/mol
LogP5.05
Rot. Bonds11

About dimethyl-(3-methylbut-2-enoxy)-octoxysilane

dimethyl-(3-methylbut-2-enoxy)-octoxysilane (PubChem CID 91739054) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is dimethyl-(3-methylbut-2-enoxy)-octoxysilane.

Molecular Properties

Compound Namedimethyl-(3-methylbut-2-enoxy)-octoxysilane
PubChem CID91739054
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Namedimethyl-(3-methylbut-2-enoxy)-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)OCC=C(C)C
InChIInChI=1S/C15H32O2Si/c1-6-7-8-9-10-11-13-16-18(4,5)17-14-12-15(2)3/h12H,6-11,13-14H2,1-5H3
InChIKeyUMAQUABZVBMMSY-UHFFFAOYSA-N
XLogP5.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.50
LogP ≤ 55.05
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

[(2E)-3,7-dimethylocta-2,6-dienoxy]-dimethyl-octoxysilane
CID 91697248
hexoxy-dimethyl-nonoxysilane
CID 91741085
hexoxy-dimethyl-undecoxysilane
CID 91742305
[(E)-but-2-enoxy]-dimethyl-octoxysilane
CID 91697268
hexadecoxy-dimethyl-[(E)-undec-2-enoxy]silane
CID 91743719
hexoxy-dimethyl-[(E)-undec-2-enoxy]silane
CID 91734985
tri(icosoxy)-methylsilane
CID 163923848
triheptoxy(methyl)silane
CID 525768
but-3-enoxy-dimethyl-nonoxysilane
CID 91736688
bis[[hexoxy(dimethyl)silyl]oxy]-dimethylsilane
CID 22506143
1-O-heptyl 4-O-(3-methylbut-2-enyl) (E)-but-2-enedioate
CID 91701301
decyl trihexyl silicate
CID 141280760

Frequently Asked Questions

What is the IUPAC name of dimethyl-(3-methylbut-2-enoxy)-octoxysilane?
The IUPAC name of dimethyl-(3-methylbut-2-enoxy)-octoxysilane (CID 91739054) is dimethyl-(3-methylbut-2-enoxy)-octoxysilane.
What is the SMILES notation for dimethyl-(3-methylbut-2-enoxy)-octoxysilane?
The canonical SMILES for dimethyl-(3-methylbut-2-enoxy)-octoxysilane is CCCCCCCCO[Si](C)(C)OCC=C(C)C.
What is the InChIKey of dimethyl-(3-methylbut-2-enoxy)-octoxysilane?
The InChIKey is UMAQUABZVBMMSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-6-7-8-9-10-11-13-16-18(4,5)17-14-12-15(2)3/h12H,6-11,13-14H2,1-5H3.
What are the key properties of dimethyl-(3-methylbut-2-enoxy)-octoxysilane?
dimethyl-(3-methylbut-2-enoxy)-octoxysilane has a molecular weight of 272.50 g/mol, XLogP of 5.05, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(3-methylbut-2-enoxy)-octoxysilane is sourced from PubChem (CID 91739054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).