tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane

C14H28O2Si — CID 125469994

IUPACtert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane
SMILESCOC=C1CCC(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C14H28O2Si/c1-14(2,3)17(5,6)16-13-9-7-12(8-10-13)11-15-4/h11,13H,7-10H2,1-6H3/b12-11-
InChIKeyLOQXZAYVNDHXBY-QXMHVHEDSA-N
MW256.46 g/mol
LogP4.48
Rot. Bonds3

About tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane

tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane (PubChem CID 125469994) has the molecular formula C14H28O2Si and a molecular weight of 256.46 g/mol. Its IUPAC name is tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane
PubChem CID125469994
Molecular FormulaC14H28O2Si
Molecular Weight256.46 g/mol
Exact Mass256.19
IUPAC Nametert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane
SMILESCOC=C1CCC(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C14H28O2Si/c1-14(2,3)17(5,6)16-13-9-7-12(8-10-13)11-15-4/h11,13H,7-10H2,1-6H3/b12-11-
InChIKeyLOQXZAYVNDHXBY-QXMHVHEDSA-N
XLogP4.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
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': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane (CID 125469994) is tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane is COC=C1CCC(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane?
The InChIKey is LOQXZAYVNDHXBY-QXMHVHEDSA-N. The full InChI is InChI=1S/C14H28O2Si/c1-14(2,3)17(5,6)16-13-9-7-12(8-10-13)11-15-4/h11,13H,7-10H2,1-6H3/b12-11-.
What are the key properties of tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane?
tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane has a molecular weight of 256.46 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-(methoxymethylidene)cyclohexyl]oxy-dimethylsilane is sourced from PubChem (CID 125469994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).