(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane

C19H32OSi — CID 102247971

IUPAC(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane
SMILESC=Cc1cc(C(C)(C)C)c(O[Si](C)(C)C)c(C(C)(C)C)c1
InChIInChI=1S/C19H32OSi/c1-11-14-12-15(18(2,3)4)17(20-21(8,9)10)16(13-14)19(5,6)7/h11-13H,1H2,2-10H3
InChIKeyRRBUAHQJTPBGSW-UHFFFAOYSA-N
MW304.55 g/mol
LogP6.14
Rot. Bonds3

About (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane

(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane (PubChem CID 102247971) has the molecular formula C19H32OSi and a molecular weight of 304.55 g/mol. Its IUPAC name is (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane.

Molecular Properties

Compound Name(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane
PubChem CID102247971
Molecular FormulaC19H32OSi
Molecular Weight304.55 g/mol
Exact Mass304.22
IUPAC Name(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane
SMILESC=Cc1cc(C(C)(C)C)c(O[Si](C)(C)C)c(C(C)(C)C)c1
InChIInChI=1S/C19H32OSi/c1-11-14-12-15(18(2,3)4)17(20-21(8,9)10)16(13-14)19(5,6)7/h11-13H,1H2,2-10H3
InChIKeyRRBUAHQJTPBGSW-UHFFFAOYSA-N
XLogP6.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.55
LogP ≤ 56.14
H-Bond Donors ≤ 50
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 (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane?
The IUPAC name of (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane (CID 102247971) is (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane.
What is the SMILES notation for (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane?
The canonical SMILES for (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane is C=Cc1cc(C(C)(C)C)c(O[Si](C)(C)C)c(C(C)(C)C)c1.
What is the InChIKey of (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane?
The InChIKey is RRBUAHQJTPBGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32OSi/c1-11-14-12-15(18(2,3)4)17(20-21(8,9)10)16(13-14)19(5,6)7/h11-13H,1H2,2-10H3.
What are the key properties of (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane?
(2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane has a molecular weight of 304.55 g/mol, XLogP of 6.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-ditert-butyl-4-ethenylphenoxy)-trimethylsilane is sourced from PubChem (CID 102247971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).