tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane

C14H28O2Si — CID 135080177

IUPACtert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
SMILESCCOC1=C(C)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C14H28O2Si/c1-8-15-12-9-10-13(11(12)2)16-17(6,7)14(3,4)5/h13H,8-10H2,1-7H3
InChIKeyXQHCMQPNMLTSKV-UHFFFAOYSA-N
MW256.46 g/mol
LogP4.48
Rot. Bonds4

About tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane

tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane (PubChem CID 135080177) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
PubChem CID135080177
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Nametert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane
SMILESCCOC1=C(C)C(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C14H28O2Si/c1-8-15-12-9-10-13(11(12)2)16-17(6,7)14(3,4)5/h13H,8-10H2,1-7H3
InChIKeyXQHCMQPNMLTSKV-UHFFFAOYSA-N
XLogP4.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.46
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyl-[(2-methoxycyclopenten-1-yl)methoxy]-dimethylsilane
CID 67557197
Tert-butyl-dimethyl-(2-methyl-3-trimethylsilyloxycyclopent-2-en-1-yl)oxysilane
CID 102435319

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane (CID 135080177) is tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane is CCOC1=C(C)C(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane?
The InChIKey is XQHCMQPNMLTSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-8-15-12-9-10-13(11(12)2)16-17(6,7)14(3,4)5/h13H,8-10H2,1-7H3.
What are the key properties of tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane?
tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane has a molecular weight of 256.46 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(3-ethoxy-2-methylcyclopent-2-en-1-yl)oxy-dimethylsilane is sourced from PubChem (CID 135080177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).