tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane

C24H34OSi — CID 135026406

IUPACtert-butyl-(6-methylhept-6-enoxy)-diphenylsilane
SMILESC=C(C)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H34OSi/c1-21(2)15-9-8-14-20-25-26(24(3,4)5,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h6-7,10-13,16-19H,1,8-9,14-15,20H2,2-5H3
InChIKeySGLOOOIBIDMSOK-UHFFFAOYSA-N
MW366.62 g/mol
LogP5.70
Rot. Bonds9

About tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane

tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane (PubChem CID 135026406) has the molecular formula C24H34OSi and a molecular weight of 366.62 g/mol. Its IUPAC name is tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-(6-methylhept-6-enoxy)-diphenylsilane
PubChem CID135026406
Molecular FormulaC24H34OSi
Molecular Weight366.62 g/mol
Exact Mass366.24
IUPAC Nametert-butyl-(6-methylhept-6-enoxy)-diphenylsilane
SMILESC=C(C)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C24H34OSi/c1-21(2)15-9-8-14-20-25-26(24(3,4)5,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h6-7,10-13,16-19H,1,8-9,14-15,20H2,2-5H3
InChIKeySGLOOOIBIDMSOK-UHFFFAOYSA-N
XLogP5.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.62
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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'}

Analyze tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane?
The IUPAC name of tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane (CID 135026406) is tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane.
What is the SMILES notation for tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane?
The canonical SMILES for tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane is C=C(C)CCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane?
The InChIKey is SGLOOOIBIDMSOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34OSi/c1-21(2)15-9-8-14-20-25-26(24(3,4)5,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h6-7,10-13,16-19H,1,8-9,14-15,20H2,2-5H3.
What are the key properties of tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane?
tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane has a molecular weight of 366.62 g/mol, XLogP of 5.70, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(6-methylhept-6-enoxy)-diphenylsilane is sourced from PubChem (CID 135026406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).