tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane

C15H30O2Si — CID 42611336

IUPACtert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane
SMILESC=C(/C=C/OCC)CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O2Si/c1-8-16-13-11-14(2)10-9-12-17-18(6,7)15(3,4)5/h11,13H,2,8-10,12H2,1,3-7H3/b13-11+
InChIKeyPSMZFKAOUGPAEB-ACCUITESSA-N
MW270.49 g/mol
LogP4.89
Rot. Bonds8

About tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane

tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane (PubChem CID 42611336) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane
PubChem CID42611336
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Nametert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane
SMILESC=C(/C=C/OCC)CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H30O2Si/c1-8-16-13-11-14(2)10-9-12-17-18(6,7)15(3,4)5/h11,13H,2,8-10,12H2,1,3-7H3/b13-11+
InChIKeyPSMZFKAOUGPAEB-ACCUITESSA-N
XLogP4.89
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 54.89
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': 'polyene', 'substructure': 'N/A'}

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Related Compounds

Tert-butyl-hex-5-enyloxy-dimethyl-silane
CID 11085343
Triethoxy(4-methylidenehex-5-en-1-yl)silane
CID 71367459
Tert-butyl-dimethyl-(4-methylidenehex-5-enoxy)silane
CID 15647203
tert-butyl-[(Z)-1-methoxyhex-1-en-2-yl]oxy-dimethylsilane
CID 134896123
tert-butyl-[(1E)-2-ethylbuta-1,3-dienoxy]-dimethylsilane
CID 135044978
Tert-butyl-dimethyl-(2-methylidenehex-5-enoxy)silane
CID 10680782
3-Hex-5-enoxypropyl-dimethoxy-methylsilane
CID 89601209
3-(Methoxymethylidene)hex-1-en-2-yloxy-trimethylsilane
CID 139909200
6-Methoxyhex-1-enoxy(trimethyl)silane
CID 140333715
Hex-1-enoxymethyl-methoxy-dimethylsilane
CID 150021381
Ethoxy-(hex-1-enoxymethyl)-dimethylsilane
CID 150151012
Diethoxy-methyl-(5-prop-1-enoxypentyl)silane
CID 150654399

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane (CID 42611336) is tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane is C=C(/C=C/OCC)CCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane?
The InChIKey is PSMZFKAOUGPAEB-ACCUITESSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-8-16-13-11-14(2)10-9-12-17-18(6,7)15(3,4)5/h11,13H,2,8-10,12H2,1,3-7H3/b13-11+.
What are the key properties of tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane?
tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane has a molecular weight of 270.49 g/mol, XLogP of 4.89, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-6-ethoxy-4-methylidenehex-5-enoxy]-dimethylsilane is sourced from PubChem (CID 42611336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).