tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane

C12H24O2Si — CID 11817041

IUPACtert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane
SMILESC/C=C\C=C(\OC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H24O2Si/c1-8-9-10-11(13-5)14-15(6,7)12(2,3)4/h8-10H,1-7H3/b9-8-,11-10-
InChIKeyJLQYAEJCAVLHKV-XESWYYRISA-N
MW228.41 g/mol
LogP4.07
Rot. Bonds4

About tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane

tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane (PubChem CID 11817041) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane
PubChem CID11817041
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Nametert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane
SMILESC/C=C\C=C(\OC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H24O2Si/c1-8-9-10-11(13-5)14-15(6,7)12(2,3)4/h8-10H,1-7H3/b9-8-,11-10-
InChIKeyJLQYAEJCAVLHKV-XESWYYRISA-N
XLogP4.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 54.07
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'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane (CID 11817041) is tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane is C/C=C\C=C(\OC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane?
The InChIKey is JLQYAEJCAVLHKV-XESWYYRISA-N. The full InChI is InChI=1S/C12H24O2Si/c1-8-9-10-11(13-5)14-15(6,7)12(2,3)4/h8-10H,1-7H3/b9-8-,11-10-.
What are the key properties of tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane?
tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane has a molecular weight of 228.41 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(1Z,3Z)-1-methoxypenta-1,3-dienoxy]-dimethylsilane is sourced from PubChem (CID 11817041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).