[(E)-but-2-enoxy]-dimethyl-octoxysilane

C14H30O2Si — CID 91697268

IUPAC[(E)-but-2-enoxy]-dimethyl-octoxysilane
SMILESC/C=C/CO[Si](C)(C)OCCCCCCCC
InChIInChI=1S/C14H30O2Si/c1-5-7-9-10-11-12-14-16-17(3,4)15-13-8-6-2/h6,8H,5,7,9-14H2,1-4H3/b8-6+
InChIKeyJBFLUTYXZCILHH-SOFGYWHQSA-N
MW258.48 g/mol
LogP4.66
Rot. Bonds11

About [(E)-but-2-enoxy]-dimethyl-octoxysilane

[(E)-but-2-enoxy]-dimethyl-octoxysilane (PubChem CID 91697268) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is [(E)-but-2-enoxy]-dimethyl-octoxysilane.

Molecular Properties

Compound Name[(E)-but-2-enoxy]-dimethyl-octoxysilane
PubChem CID91697268
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Name[(E)-but-2-enoxy]-dimethyl-octoxysilane
SMILESC/C=C/CO[Si](C)(C)OCCCCCCCC
InChIInChI=1S/C14H30O2Si/c1-5-7-9-10-11-12-14-16-17(3,4)15-13-8-6-2/h6,8H,5,7,9-14H2,1-4H3/b8-6+
InChIKeyJBFLUTYXZCILHH-SOFGYWHQSA-N
XLogP4.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.66
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

hexadecoxy-dimethyl-[(E)-undec-2-enoxy]silane
CID 91743719
hexoxy-dimethyl-[(E)-undec-2-enoxy]silane
CID 91734985
hexoxy-dimethyl-nonoxysilane
CID 91741085
hexoxy-dimethyl-undecoxysilane
CID 91742305
dimethyl-(3-methylbut-2-enoxy)-octoxysilane
CID 91739054
dimethyl-propoxy-[(E)-undec-2-enoxy]silane
CID 91726222
1-[(E)-but-2-enoxy]hexadecane
CID 88726636
1-but-2-enoxyoctadecane
CID 123608986
but-3-enoxy-dimethyl-nonoxysilane
CID 91736688
[(2E)-3,7-dimethylocta-2,6-dienoxy]-dimethyl-octoxysilane
CID 91697248
bis[[hexoxy(dimethyl)silyl]oxy]-dimethylsilane
CID 22506143
bis[(E)-hex-4-enoxy]-dimethylsilane
CID 91697811

Frequently Asked Questions

What is the IUPAC name of [(E)-but-2-enoxy]-dimethyl-octoxysilane?
The IUPAC name of [(E)-but-2-enoxy]-dimethyl-octoxysilane (CID 91697268) is [(E)-but-2-enoxy]-dimethyl-octoxysilane.
What is the SMILES notation for [(E)-but-2-enoxy]-dimethyl-octoxysilane?
The canonical SMILES for [(E)-but-2-enoxy]-dimethyl-octoxysilane is C/C=C/CO[Si](C)(C)OCCCCCCCC.
What is the InChIKey of [(E)-but-2-enoxy]-dimethyl-octoxysilane?
The InChIKey is JBFLUTYXZCILHH-SOFGYWHQSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-5-7-9-10-11-12-14-16-17(3,4)15-13-8-6-2/h6,8H,5,7,9-14H2,1-4H3/b8-6+.
What are the key properties of [(E)-but-2-enoxy]-dimethyl-octoxysilane?
[(E)-but-2-enoxy]-dimethyl-octoxysilane has a molecular weight of 258.48 g/mol, XLogP of 4.66, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-but-2-enoxy]-dimethyl-octoxysilane is sourced from PubChem (CID 91697268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).