tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane

C12H24OSi — CID 57277654

IUPACtert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane
SMILESCC1=CCC(O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C12H24OSi/c1-10-7-8-11(9-10)13-14(5,6)12(2,3)4/h7,11H,8-9H2,1-6H3
InChIKeyGXNAMLPTLSJAFA-UHFFFAOYSA-N
MW212.41 g/mol
LogP4.12
Rot. Bonds2

About tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane

tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane (PubChem CID 57277654) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane
PubChem CID57277654
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Nametert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane
SMILESCC1=CCC(O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C12H24OSi/c1-10-7-8-11(9-10)13-14(5,6)12(2,3)4/h7,11H,8-9H2,1-6H3
InChIKeyGXNAMLPTLSJAFA-UHFFFAOYSA-N
XLogP4.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane?
The IUPAC name of tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane (CID 57277654) is tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane?
The canonical SMILES for tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane is CC1=CCC(O[Si](C)(C)C(C)(C)C)C1.
What is the InChIKey of tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane?
The InChIKey is GXNAMLPTLSJAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24OSi/c1-10-7-8-11(9-10)13-14(5,6)12(2,3)4/h7,11H,8-9H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane?
tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane has a molecular weight of 212.41 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(3-methylcyclopent-3-en-1-yl)oxysilane is sourced from PubChem (CID 57277654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).