(2-tert-butylphenyl)-hydroxy-phenylsilane

C16H20OSi — CID 137327497

IUPAC(2-tert-butylphenyl)-hydroxy-phenylsilane
SMILESCC(C)(C)c1ccccc1[SiH](O)c1ccccc1
InChIInChI=1S/C16H20OSi/c1-16(2,3)14-11-7-8-12-15(14)18(17)13-9-5-4-6-10-13/h4-12,17-18H,1-3H3
InChIKeyVZONGJHEOXRGFB-UHFFFAOYSA-N
MW256.42 g/mol
LogP1.81
Rot. Bonds2

About (2-tert-butylphenyl)-hydroxy-phenylsilane

(2-tert-butylphenyl)-hydroxy-phenylsilane (PubChem CID 137327497) has the molecular formula C16H20OSi and a molecular weight of 256.42 g/mol. Its IUPAC name is (2-tert-butylphenyl)-hydroxy-phenylsilane.

Molecular Properties

Compound Name(2-tert-butylphenyl)-hydroxy-phenylsilane
PubChem CID137327497
Molecular FormulaC16H20OSi
Molecular Weight256.42 g/mol
Exact Mass256.13
IUPAC Name(2-tert-butylphenyl)-hydroxy-phenylsilane
SMILESCC(C)(C)c1ccccc1[SiH](O)c1ccccc1
InChIInChI=1S/C16H20OSi/c1-16(2,3)14-11-7-8-12-15(14)18(17)13-9-5-4-6-10-13/h4-12,17-18H,1-3H3
InChIKeyVZONGJHEOXRGFB-UHFFFAOYSA-N
XLogP1.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.42
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-tert-butylphenyl)-hydroxy-phenylsilane?
The IUPAC name of (2-tert-butylphenyl)-hydroxy-phenylsilane (CID 137327497) is (2-tert-butylphenyl)-hydroxy-phenylsilane.
What is the SMILES notation for (2-tert-butylphenyl)-hydroxy-phenylsilane?
The canonical SMILES for (2-tert-butylphenyl)-hydroxy-phenylsilane is CC(C)(C)c1ccccc1[SiH](O)c1ccccc1.
What is the InChIKey of (2-tert-butylphenyl)-hydroxy-phenylsilane?
The InChIKey is VZONGJHEOXRGFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20OSi/c1-16(2,3)14-11-7-8-12-15(14)18(17)13-9-5-4-6-10-13/h4-12,17-18H,1-3H3.
What are the key properties of (2-tert-butylphenyl)-hydroxy-phenylsilane?
(2-tert-butylphenyl)-hydroxy-phenylsilane has a molecular weight of 256.42 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butylphenyl)-hydroxy-phenylsilane is sourced from PubChem (CID 137327497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).