tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane

C14H26O2Si — CID 163287177

IUPACtert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCO/C=C1/CC=CCC1
InChIInChI=1S/C14H26O2Si/c1-14(2,3)17(4,5)16-12-15-11-13-9-7-6-8-10-13/h6-7,11H,8-10,12H2,1-5H3/b13-11-
InChIKeyHQHXGWKIWWTMHF-QBFSEMIESA-N
MW254.45 g/mol
LogP4.61
Rot. Bonds4

About tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane

tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane (PubChem CID 163287177) has the molecular formula C14H26O2Si and a molecular weight of 254.45 g/mol. Its IUPAC name is tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane
PubChem CID163287177
Molecular FormulaC14H26O2Si
Molecular Weight254.45 g/mol
Exact Mass254.17
IUPAC Nametert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCO/C=C1/CC=CCC1
InChIInChI=1S/C14H26O2Si/c1-14(2,3)17(4,5)16-12-15-11-13-9-7-6-8-10-13/h6-7,11H,8-10,12H2,1-5H3/b13-11-
InChIKeyHQHXGWKIWWTMHF-QBFSEMIESA-N
XLogP4.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[(Z)-ethoxy-(4-methyl-2-methylidenecyclohex-3-en-1-ylidene)methoxy]-trimethylsilane
CID 13453660
[(Cyclohexylidenemethoxy)methoxy](trimethyl)silane
CID 69079709
tert-butyl-dimethyl-[[(4Z,9E)-3,6,7,8-tetrahydro-2H-oxecin-10-yl]oxy]silane
CID 11536324
{[2-(Cyclohex-1-en-1-yl)-1-ethoxyethenyl]oxy}(trimethyl)silane
CID 71347105

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane (CID 163287177) is tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCO/C=C1/CC=CCC1.
What is the InChIKey of tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane?
The InChIKey is HQHXGWKIWWTMHF-QBFSEMIESA-N. The full InChI is InChI=1S/C14H26O2Si/c1-14(2,3)17(4,5)16-12-15-11-13-9-7-6-8-10-13/h6-7,11H,8-10,12H2,1-5H3/b13-11-.
What are the key properties of tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane?
tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane has a molecular weight of 254.45 g/mol, XLogP of 4.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(E)-cyclohex-3-en-1-ylidenemethoxy]methoxy]-dimethylsilane is sourced from PubChem (CID 163287177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).