nonoxy-pent-4-enoxy-diphenylsilane

C26H38O2Si — CID 91732720

IUPACnonoxy-pent-4-enoxy-diphenylsilane
SMILESC=CCCCO[Si](OCCCCCCCCC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H38O2Si/c1-3-5-7-8-9-10-18-24-28-29(27-23-17-6-4-2,25-19-13-11-14-20-25)26-21-15-12-16-22-26/h4,11-16,19-22H,2-3,5-10,17-18,23-24H2,1H3
InChIKeyMUCWCZAGNZOYHU-UHFFFAOYSA-N
MW410.67 g/mol
LogP5.99
Rot. Bonds16

About nonoxy-pent-4-enoxy-diphenylsilane

nonoxy-pent-4-enoxy-diphenylsilane (PubChem CID 91732720) has the molecular formula C26H38O2Si and a molecular weight of 410.67 g/mol. Its IUPAC name is nonoxy-pent-4-enoxy-diphenylsilane.

Molecular Properties

Compound Namenonoxy-pent-4-enoxy-diphenylsilane
PubChem CID91732720
Molecular FormulaC26H38O2Si
Molecular Weight410.67 g/mol
Exact Mass410.26
IUPAC Namenonoxy-pent-4-enoxy-diphenylsilane
SMILESC=CCCCO[Si](OCCCCCCCCC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H38O2Si/c1-3-5-7-8-9-10-18-24-28-29(27-23-17-6-4-2,25-19-13-11-14-20-25)26-21-15-12-16-22-26/h4,11-16,19-22H,2-3,5-10,17-18,23-24H2,1H3
InChIKeyMUCWCZAGNZOYHU-UHFFFAOYSA-N
XLogP5.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.67
LogP ≤ 55.99
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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Frequently Asked Questions

What is the IUPAC name of nonoxy-pent-4-enoxy-diphenylsilane?
The IUPAC name of nonoxy-pent-4-enoxy-diphenylsilane (CID 91732720) is nonoxy-pent-4-enoxy-diphenylsilane.
What is the SMILES notation for nonoxy-pent-4-enoxy-diphenylsilane?
The canonical SMILES for nonoxy-pent-4-enoxy-diphenylsilane is C=CCCCO[Si](OCCCCCCCCC)(c1ccccc1)c1ccccc1.
What is the InChIKey of nonoxy-pent-4-enoxy-diphenylsilane?
The InChIKey is MUCWCZAGNZOYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H38O2Si/c1-3-5-7-8-9-10-18-24-28-29(27-23-17-6-4-2,25-19-13-11-14-20-25)26-21-15-12-16-22-26/h4,11-16,19-22H,2-3,5-10,17-18,23-24H2,1H3.
What are the key properties of nonoxy-pent-4-enoxy-diphenylsilane?
nonoxy-pent-4-enoxy-diphenylsilane has a molecular weight of 410.67 g/mol, XLogP of 5.99, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nonoxy-pent-4-enoxy-diphenylsilane is sourced from PubChem (CID 91732720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).