cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane

C18H28OSi — CID 70015343

IUPACcyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane
SMILESCC1=CC=CCC1(OC(C)(C)C)[Si](C)(C)C1=CC=CC1
InChIInChI=1S/C18H28OSi/c1-15-11-9-10-14-18(15,19-17(2,3)4)20(5,6)16-12-7-8-13-16/h7-12H,13-14H2,1-6H3
InChIKeyRPRAYKLBASYZOC-UHFFFAOYSA-N
MW288.51 g/mol
LogP5.12
Rot. Bonds3

About cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane

cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane (PubChem CID 70015343) has the molecular formula C18H28OSi and a molecular weight of 288.51 g/mol. Its IUPAC name is cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane.

Molecular Properties

Compound Namecyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane
PubChem CID70015343
Molecular FormulaC18H28OSi
Molecular Weight288.51 g/mol
Exact Mass288.19
IUPAC Namecyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane
SMILESCC1=CC=CCC1(OC(C)(C)C)[Si](C)(C)C1=CC=CC1
InChIInChI=1S/C18H28OSi/c1-15-11-9-10-14-18(15,19-17(2,3)4)20(5,6)16-12-7-8-13-16/h7-12H,13-14H2,1-6H3
InChIKeyRPRAYKLBASYZOC-UHFFFAOYSA-N
XLogP5.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.51
LogP ≤ 55.12
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 cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane?
The IUPAC name of cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane (CID 70015343) is cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane.
What is the SMILES notation for cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane?
The canonical SMILES for cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane is CC1=CC=CCC1(OC(C)(C)C)[Si](C)(C)C1=CC=CC1.
What is the InChIKey of cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane?
The InChIKey is RPRAYKLBASYZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28OSi/c1-15-11-9-10-14-18(15,19-17(2,3)4)20(5,6)16-12-7-8-13-16/h7-12H,13-14H2,1-6H3.
What are the key properties of cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane?
cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane has a molecular weight of 288.51 g/mol, XLogP of 5.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-dien-1-yl-dimethyl-[2-methyl-1-[(2-methylpropan-2-yl)oxy]cyclohexa-2,4-dien-1-yl]silane is sourced from PubChem (CID 70015343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).