2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane

C12H22OSi — CID 134940186

IUPAC2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane
SMILESCC(C)(O[Si](C)(C)C)C1C=CC=CC1
InChIInChI=1S/C12H22OSi/c1-12(2,13-14(3,4)5)11-9-7-6-8-10-11/h6-9,11H,10H2,1-5H3
InChIKeyAARQFFPSUXJNQC-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.75
Rot. Bonds3

About 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane

2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane (PubChem CID 134940186) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane.

Molecular Properties

Compound Name2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane
PubChem CID134940186
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane
SMILESCC(C)(O[Si](C)(C)C)C1C=CC=CC1
InChIInChI=1S/C12H22OSi/c1-12(2,13-14(3,4)5)11-9-7-6-8-10-11/h6-9,11H,10H2,1-5H3
InChIKeyAARQFFPSUXJNQC-UHFFFAOYSA-N
XLogP3.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.75
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-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane?
The IUPAC name of 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane (CID 134940186) is 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane.
What is the SMILES notation for 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane?
The canonical SMILES for 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane is CC(C)(O[Si](C)(C)C)C1C=CC=CC1.
What is the InChIKey of 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane?
The InChIKey is AARQFFPSUXJNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-12(2,13-14(3,4)5)11-9-7-6-8-10-11/h6-9,11H,10H2,1-5H3.
What are the key properties of 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane?
2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane has a molecular weight of 210.39 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexa-2,4-dien-1-ylpropan-2-yloxy(trimethyl)silane is sourced from PubChem (CID 134940186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).