dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane

C28H58O4Si2 — CID 123897190

IUPACdibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane
SMILESCCCC=C[Si](CC[Si](C=CCCC)(OCCCC)OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C28H58O4Si2/c1-7-13-19-25-33(29-21-15-9-3,30-22-16-10-4)27-28-34(26-20-14-8-2,31-23-17-11-5)32-24-18-12-6/h19-20,25-26H,7-18,21-24,27-28H2,1-6H3
InChIKeyZFHCNFPLLXWOQF-UHFFFAOYSA-N
MW514.94 g/mol
LogP8.93
Rot. Bonds25

About dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane

dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane (PubChem CID 123897190) has the molecular formula C28H58O4Si2 and a molecular weight of 514.94 g/mol. Its IUPAC name is dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane.

Molecular Properties

Compound Namedibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane
PubChem CID123897190
Molecular FormulaC28H58O4Si2
Molecular Weight514.94 g/mol
Exact Mass514.39
IUPAC Namedibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane
SMILESCCCC=C[Si](CC[Si](C=CCCC)(OCCCC)OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C28H58O4Si2/c1-7-13-19-25-33(29-21-15-9-3,30-22-16-10-4)27-28-34(26-20-14-8-2,31-23-17-11-5)32-24-18-12-6/h19-20,25-26H,7-18,21-24,27-28H2,1-6H3
InChIKeyZFHCNFPLLXWOQF-UHFFFAOYSA-N
XLogP8.93
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds25
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.94
LogP ≤ 58.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

dibutoxy-[3-[dibutoxy(hex-1-enyl)silyl]propyl]-hex-1-enylsilane
CID 123827090
2-[diethoxy(pent-1-enyl)silyl]ethyl-diethoxy-pent-1-enylsilane
CID 123302721
dibutoxy-[2-[dibutoxy(prop-1-enyl)silyl]ethyl]-prop-1-enylsilane
CID 123692840
hex-1-enyl-[3-[hex-1-enyl(dipropoxy)silyl]propyl]-dipropoxysilane
CID 123749163
dibutoxy-dec-1-enyl-ethylsilane
CID 155797338
dibutoxy-[1-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane
CID 87177624
diethoxy-ethyl-hex-1-enylsilane
CID 154083914
dibutoxy-ethenyl-ethylsilane
CID 54379012
butoxy(tributyl)silane
CID 594608
triethoxy-[(E)-hex-1-enyl]silane
CID 11184190
butoxy-ethenyl-ethoxy-ethylsilane
CID 174331125
tributoxy(pent-4-enyl)silane
CID 87220706

Frequently Asked Questions

What is the IUPAC name of dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane?
The IUPAC name of dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane (CID 123897190) is dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane.
What is the SMILES notation for dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane?
The canonical SMILES for dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane is CCCC=C[Si](CC[Si](C=CCCC)(OCCCC)OCCCC)(OCCCC)OCCCC.
What is the InChIKey of dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane?
The InChIKey is ZFHCNFPLLXWOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H58O4Si2/c1-7-13-19-25-33(29-21-15-9-3,30-22-16-10-4)27-28-34(26-20-14-8-2,31-23-17-11-5)32-24-18-12-6/h19-20,25-26H,7-18,21-24,27-28H2,1-6H3.
What are the key properties of dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane?
dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane has a molecular weight of 514.94 g/mol, XLogP of 8.93, 25 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-[2-[dibutoxy(pent-1-enyl)silyl]ethyl]-pent-1-enylsilane is sourced from PubChem (CID 123897190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).