but-3-enoxy-hexoxy-dimethylsilane

C12H26O2Si — CID 91730309

IUPACbut-3-enoxy-hexoxy-dimethylsilane
SMILESC=CCCO[Si](C)(C)OCCCCCC
InChIInChI=1S/C12H26O2Si/c1-5-7-9-10-12-14-15(3,4)13-11-8-6-2/h6H,2,5,7-12H2,1,3-4H3
InChIKeySHDIBFWJARPTHJ-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.88
Rot. Bonds10

About but-3-enoxy-hexoxy-dimethylsilane

but-3-enoxy-hexoxy-dimethylsilane (PubChem CID 91730309) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is but-3-enoxy-hexoxy-dimethylsilane.

Molecular Properties

Compound Namebut-3-enoxy-hexoxy-dimethylsilane
PubChem CID91730309
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Namebut-3-enoxy-hexoxy-dimethylsilane
SMILESC=CCCO[Si](C)(C)OCCCCCC
InChIInChI=1S/C12H26O2Si/c1-5-7-9-10-12-14-15(3,4)13-11-8-6-2/h6H,2,5,7-12H2,1,3-4H3
InChIKeySHDIBFWJARPTHJ-UHFFFAOYSA-N
XLogP3.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.88
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

bis(Hex-5-en-1-yloxy)(dimethyl)silane
CID 21472933
Silane, dimethyldi(but-3-enyloxy)-
CID 12929517
Trimethyl(undec-10-enoxy)silane
CID 554429
9-Decen-1-ol, TMS derivative
CID 12578077
Silane, dimethyl(but-3-enyloxy)isohexyloxy-
CID 91698242
Silane, dimethyl(dimethyl(but-3-enyloxy)silyloxy)octadecyloxy-
CID 91720882
Silane, dimethyl(but-3-enyloxy)pentyloxy-
CID 91726714
Silane, dimethyl(3-methylbut-3-enyloxy)hexyloxy-
CID 91730344
Silane, dimethyl(non-3-enyloxy)hexyloxy-
CID 91730345
Silane, dimethyl(dimethyl(but-3-enyloxy)silyloxy)butoxy-
CID 91733517
Silane, dimethyl(but-3-enyloxy)octyloxy-
CID 91735257
Silane, dimethyl(but-3-enyloxy)nonyloxy-
CID 91736688

Frequently Asked Questions

What is the IUPAC name of but-3-enoxy-hexoxy-dimethylsilane?
The IUPAC name of but-3-enoxy-hexoxy-dimethylsilane (CID 91730309) is but-3-enoxy-hexoxy-dimethylsilane.
What is the SMILES notation for but-3-enoxy-hexoxy-dimethylsilane?
The canonical SMILES for but-3-enoxy-hexoxy-dimethylsilane is C=CCCO[Si](C)(C)OCCCCCC.
What is the InChIKey of but-3-enoxy-hexoxy-dimethylsilane?
The InChIKey is SHDIBFWJARPTHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-5-7-9-10-12-14-15(3,4)13-11-8-6-2/h6H,2,5,7-12H2,1,3-4H3.
What are the key properties of but-3-enoxy-hexoxy-dimethylsilane?
but-3-enoxy-hexoxy-dimethylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.88, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enoxy-hexoxy-dimethylsilane is sourced from PubChem (CID 91730309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).