2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane

C16H24OSi — CID 175168382

IUPAC2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane
SMILESC=C(C)[Si]1(c2ccccc2C(C)C)CCCCO1
InChIInChI=1S/C16H24OSi/c1-13(2)15-9-5-6-10-16(15)18(14(3)4)12-8-7-11-17-18/h5-6,9-10,13H,3,7-8,11-12H2,1-2,4H3
InChIKeyBCYHDABVUFMKTB-UHFFFAOYSA-N
MW260.45 g/mol
LogP3.89
Rot. Bonds3

About 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane

2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane (PubChem CID 175168382) has the molecular formula C16H24OSi and a molecular weight of 260.45 g/mol. Its IUPAC name is 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane.

Molecular Properties

Compound Name2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane
PubChem CID175168382
Molecular FormulaC16H24OSi
Molecular Weight260.45 g/mol
Exact Mass260.16
IUPAC Name2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane
SMILESC=C(C)[Si]1(c2ccccc2C(C)C)CCCCO1
InChIInChI=1S/C16H24OSi/c1-13(2)15-9-5-6-10-16(15)18(14(3)4)12-8-7-11-17-18/h5-6,9-10,13H,3,7-8,11-12H2,1-2,4H3
InChIKeyBCYHDABVUFMKTB-UHFFFAOYSA-N
XLogP3.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 53.89
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-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane?
The IUPAC name of 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane (CID 175168382) is 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane.
What is the SMILES notation for 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane?
The canonical SMILES for 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane is C=C(C)[Si]1(c2ccccc2C(C)C)CCCCO1.
What is the InChIKey of 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane?
The InChIKey is BCYHDABVUFMKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24OSi/c1-13(2)15-9-5-6-10-16(15)18(14(3)4)12-8-7-11-17-18/h5-6,9-10,13H,3,7-8,11-12H2,1-2,4H3.
What are the key properties of 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane?
2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane has a molecular weight of 260.45 g/mol, XLogP of 3.89, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-ylphenyl)-2-prop-1-en-2-yloxasilinane is sourced from PubChem (CID 175168382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).