dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane

C26H40OSi2 — CID 11362290

IUPACdimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane
SMILESCC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C26H40OSi2/c1-7-29(8-2,9-3)27-26(24-20-18-23(4)19-21-24)17-13-14-22-28(5,6)25-15-11-10-12-16-25/h10-16,18-21,26H,7-9,17,22H2,1-6H3/b14-13-
InChIKeyXZVGHQNZBLTEOW-YPKPFQOOSA-N
MW424.78 g/mol
LogP7.62
Rot. Bonds11

About dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane

dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane (PubChem CID 11362290) has the molecular formula C26H40OSi2 and a molecular weight of 424.78 g/mol. Its IUPAC name is dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane.

Molecular Properties

Compound Namedimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane
PubChem CID11362290
Molecular FormulaC26H40OSi2
Molecular Weight424.78 g/mol
Exact Mass424.26
IUPAC Namedimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane
SMILESCC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C26H40OSi2/c1-7-29(8-2,9-3)27-26(24-20-18-23(4)19-21-24)17-13-14-22-28(5,6)25-15-11-10-12-16-25/h10-16,18-21,26H,7-9,17,22H2,1-6H3/b14-13-
InChIKeyXZVGHQNZBLTEOW-YPKPFQOOSA-N
XLogP7.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.78
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane?
The IUPAC name of dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane (CID 11362290) is dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane.
What is the SMILES notation for dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane?
The canonical SMILES for dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane is CC[Si](CC)(CC)OC(C/C=C\C[Si](C)(C)c1ccccc1)c1ccc(C)cc1.
What is the InChIKey of dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane?
The InChIKey is XZVGHQNZBLTEOW-YPKPFQOOSA-N. The full InChI is InChI=1S/C26H40OSi2/c1-7-29(8-2,9-3)27-26(24-20-18-23(4)19-21-24)17-13-14-22-28(5,6)25-15-11-10-12-16-25/h10-16,18-21,26H,7-9,17,22H2,1-6H3/b14-13-.
What are the key properties of dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane?
dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane has a molecular weight of 424.78 g/mol, XLogP of 7.62, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(Z)-5-(4-methylphenyl)-5-triethylsilyloxypent-2-enyl]-phenylsilane is sourced from PubChem (CID 11362290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).