tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane

C16H24OSi — CID 10989040

IUPACtert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane
SMILESCC(C)(C)[Si](O)(C1=CCCCC1)c1ccccc1
InChIInChI=1S/C16H24OSi/c1-16(2,3)18(17,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4,6-7,10-12,17H,5,8-9,13H2,1-3H3
InChIKeyGGJOGYHWBNJJDF-UHFFFAOYSA-N
MW260.45 g/mol
LogP3.67
Rot. Bonds2

About tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane

tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane (PubChem CID 10989040) has the molecular formula C16H24OSi and a molecular weight of 260.45 g/mol. Its IUPAC name is tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane.

Molecular Properties

Compound Nametert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane
PubChem CID10989040
Molecular FormulaC16H24OSi
Molecular Weight260.45 g/mol
Exact Mass260.16
IUPAC Nametert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane
SMILESCC(C)(C)[Si](O)(C1=CCCCC1)c1ccccc1
InChIInChI=1S/C16H24OSi/c1-16(2,3)18(17,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4,6-7,10-12,17H,5,8-9,13H2,1-3H3
InChIKeyGGJOGYHWBNJJDF-UHFFFAOYSA-N
XLogP3.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-(cyclohexen-1-yl)-diphenylsilane
CID 11301658
tert-butyl-(cyclopenten-1-yl)-dimethylsilane
CID 150753521
1-(cyclohexen-1-yl)-1-phenylethanol
CID 538858
hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane
CID 171400301
2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclohex-2-en-1-one
CID 86086582
[(Z)-2-(cyclohexen-1-yl)ethenyl]-methyl-diphenylsilane
CID 101364519
cyclobuten-1-yl(triphenyl)silane
CID 71421522
hydroxy(triphenyl)silane
CID 139058622
benzoic acid;tert-butyl-hydroxy-dimethylsilane
CID 71403721
1-[(1E)-cycloocten-1-yl]-2-methyl-2-phenylpropan-1-one
CID 106651815
2-(cyclohexen-1-yl)-2-hydroxy-2-phenylacetic acid
CID 15515052
1-(cyclohexen-1-yl)-2,3,3-trimethylbut-1-en-1-ol
CID 161095188

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane?
The IUPAC name of tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane (CID 10989040) is tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane.
What is the SMILES notation for tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane?
The canonical SMILES for tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane is CC(C)(C)[Si](O)(C1=CCCCC1)c1ccccc1.
What is the InChIKey of tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane?
The InChIKey is GGJOGYHWBNJJDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24OSi/c1-16(2,3)18(17,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4,6-7,10-12,17H,5,8-9,13H2,1-3H3.
What are the key properties of tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane?
tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane has a molecular weight of 260.45 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(cyclohexen-1-yl)-hydroxy-phenylsilane is sourced from PubChem (CID 10989040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).