[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane

C16H34O4Si3 — CID 134872570

IUPAC[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane
SMILESC=C(/C=C(/C=C(/OC)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C16H34O4Si3/c1-14(18-21(3,4)5)12-15(19-22(6,7)8)13-16(17-2)20-23(9,10)11/h12-13H,1H2,2-11H3/b15-12-,16-13-
InChIKeyCOWDDPHVKCEGIB-BNXAACBSSA-N
MW374.70 g/mol
LogP5.43
Rot. Bonds9

About [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane

[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane (PubChem CID 134872570) has the molecular formula C16H34O4Si3 and a molecular weight of 374.70 g/mol. Its IUPAC name is [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane
PubChem CID134872570
Molecular FormulaC16H34O4Si3
Molecular Weight374.70 g/mol
Exact Mass374.18
IUPAC Name[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane
SMILESC=C(/C=C(/C=C(/OC)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C16H34O4Si3/c1-14(18-21(3,4)5)12-15(19-22(6,7)8)13-16(17-2)20-23(9,10)11/h12-13H,1H2,2-11H3/b15-12-,16-13-
InChIKeyCOWDDPHVKCEGIB-BNXAACBSSA-N
XLogP5.43
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.70
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane?
The IUPAC name of [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane (CID 134872570) is [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane.
What is the SMILES notation for [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane?
The canonical SMILES for [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane is C=C(/C=C(/C=C(/OC)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane?
The InChIKey is COWDDPHVKCEGIB-BNXAACBSSA-N. The full InChI is InChI=1S/C16H34O4Si3/c1-14(18-21(3,4)5)12-15(19-22(6,7)8)13-16(17-2)20-23(9,10)11/h12-13H,1H2,2-11H3/b15-12-,16-13-.
What are the key properties of [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane?
[(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane has a molecular weight of 374.70 g/mol, XLogP of 5.43, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z,3Z)-1-methoxy-3,5-bis(trimethylsilyloxy)hexa-1,3,5-trienoxy]-trimethylsilane is sourced from PubChem (CID 134872570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).