[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane

C12H24OSi — CID 15706653

IUPAC[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane
SMILESC/C=C(/C=C/C(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-8-11(13-14(5,6)7)9-10-12(2,3)4/h8-10H,1-7H3/b10-9+,11-8-
InChIKeyDKCHSVFHDNWROT-PGGWCAKNSA-N
MW212.41 g/mol
LogP4.34
Rot. Bonds3

About [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane

[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane (PubChem CID 15706653) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane
PubChem CID15706653
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Name[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane
SMILESC/C=C(/C=C/C(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C12H24OSi/c1-8-11(13-14(5,6)7)9-10-12(2,3)4/h8-10H,1-7H3/b10-9+,11-8-
InChIKeyDKCHSVFHDNWROT-PGGWCAKNSA-N
XLogP4.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane?
The IUPAC name of [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane (CID 15706653) is [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane?
The canonical SMILES for [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane is C/C=C(/C=C/C(C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane?
The InChIKey is DKCHSVFHDNWROT-PGGWCAKNSA-N. The full InChI is InChI=1S/C12H24OSi/c1-8-11(13-14(5,6)7)9-10-12(2,3)4/h8-10H,1-7H3/b10-9+,11-8-.
What are the key properties of [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane?
[(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane has a molecular weight of 212.41 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z,4E)-6,6-dimethylhepta-2,4-dien-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 15706653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).