bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate

C15H30O5Si3 — CID 5463673

IUPACbis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate
SMILESC[Si](C)(C)OC(=O)/C=C(/C=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H30O5Si3/c1-21(2,3)18-13(12-15(17)20-23(7,8)9)10-11-14(16)19-22(4,5)6/h10-12H,1-9H3/b11-10+,13-12-
InChIKeyGIAYEVJAHHZGNG-MRBUWEIXSA-N
MW374.66 g/mol
LogP4.03
Rot. Bonds7

About bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate

bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate (PubChem CID 5463673) has the molecular formula C15H30O5Si3 and a molecular weight of 374.66 g/mol. Its IUPAC name is bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate
PubChem CID5463673
Molecular FormulaC15H30O5Si3
Molecular Weight374.66 g/mol
Exact Mass374.14
IUPAC Namebis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate
SMILESC[Si](C)(C)OC(=O)/C=C(/C=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H30O5Si3/c1-21(2,3)18-13(12-15(17)20-23(7,8)9)10-11-14(16)19-22(4,5)6/h10-12H,1-9H3/b11-10+,13-12-
InChIKeyGIAYEVJAHHZGNG-MRBUWEIXSA-N
XLogP4.03
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.66
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate?
The IUPAC name of bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate (CID 5463673) is bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate.
What is the SMILES notation for bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate?
The canonical SMILES for bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate is C[Si](C)(C)OC(=O)/C=C(/C=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate?
The InChIKey is GIAYEVJAHHZGNG-MRBUWEIXSA-N. The full InChI is InChI=1S/C15H30O5Si3/c1-21(2,3)18-13(12-15(17)20-23(7,8)9)10-11-14(16)19-22(4,5)6/h10-12H,1-9H3/b11-10+,13-12-.
What are the key properties of bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate?
bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate has a molecular weight of 374.66 g/mol, XLogP of 4.03, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) (2Z,4E)-3-trimethylsilyloxyhexa-2,4-dienedioate is sourced from PubChem (CID 5463673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).