tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane

C24H32O2Si — CID 16742609

IUPACtert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane
SMILESC=CC[C@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)OC=C
InChIInChI=1S/C24H32O2Si/c1-6-14-21(25-7-2)19-20-26-27(24(3,4)5,22-15-10-8-11-16-22)23-17-12-9-13-18-23/h6-13,15-18,21H,1-2,14,19-20H2,3-5H3/t21-/m1/s1
InChIKeyAMLXJIMXFSUDLZ-OAQYLSRUSA-N
MW380.60 g/mol
LogP5.06
Rot. Bonds10

About tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane

tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane (PubChem CID 16742609) has the molecular formula C24H32O2Si and a molecular weight of 380.60 g/mol. Its IUPAC name is tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane
PubChem CID16742609
Molecular FormulaC24H32O2Si
Molecular Weight380.60 g/mol
Exact Mass380.22
IUPAC Nametert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane
SMILESC=CC[C@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)OC=C
InChIInChI=1S/C24H32O2Si/c1-6-14-21(25-7-2)19-20-26-27(24(3,4)5,22-15-10-8-11-16-22)23-17-12-9-13-18-23/h6-13,15-18,21H,1-2,14,19-20H2,3-5H3/t21-/m1/s1
InChIKeyAMLXJIMXFSUDLZ-OAQYLSRUSA-N
XLogP5.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.60
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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 tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane (CID 16742609) is tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane is C=CC[C@H](CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)OC=C.
What is the InChIKey of tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane?
The InChIKey is AMLXJIMXFSUDLZ-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H32O2Si/c1-6-14-21(25-7-2)19-20-26-27(24(3,4)5,22-15-10-8-11-16-22)23-17-12-9-13-18-23/h6-13,15-18,21H,1-2,14,19-20H2,3-5H3/t21-/m1/s1.
What are the key properties of tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane?
tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane has a molecular weight of 380.60 g/mol, XLogP of 5.06, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3R)-3-ethenoxyhex-5-enoxy]-diphenylsilane is sourced from PubChem (CID 16742609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).