[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane

C13H26O2Si — CID 71275834

IUPAC[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane
SMILESCCCCOCC1=C[C@H](O[Si](C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-5-6-9-14-11-12-7-8-13(10-12)15-16(2,3)4/h10,13H,5-9,11H2,1-4H3/t13-/m1/s1
InChIKeyRGONGFPFGXPCLG-CYBMUJFWSA-N
MW242.43 g/mol
LogP3.74
Rot. Bonds7

About [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane

[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane (PubChem CID 71275834) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane
PubChem CID71275834
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane
SMILESCCCCOCC1=C[C@H](O[Si](C)(C)C)CC1
InChIInChI=1S/C13H26O2Si/c1-5-6-9-14-11-12-7-8-13(10-12)15-16(2,3)4/h10,13H,5-9,11H2,1-4H3/t13-/m1/s1
InChIKeyRGONGFPFGXPCLG-CYBMUJFWSA-N
XLogP3.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane?
The IUPAC name of [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane (CID 71275834) is [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane?
The canonical SMILES for [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane is CCCCOCC1=C[C@H](O[Si](C)(C)C)CC1.
What is the InChIKey of [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane?
The InChIKey is RGONGFPFGXPCLG-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-5-6-9-14-11-12-7-8-13(10-12)15-16(2,3)4/h10,13H,5-9,11H2,1-4H3/t13-/m1/s1.
What are the key properties of [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane?
[(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane has a molecular weight of 242.43 g/mol, XLogP of 3.74, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-3-(butoxymethyl)cyclopent-2-en-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 71275834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).