trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate

C14H30O3Si2 — CID 5366591

IUPACtrimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate
SMILESCCCCC/C=C(\O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H30O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h12H,8-11H2,1-7H3/b13-12-
InChIKeyOMNZAEOPUFBTBD-SEYXRHQNSA-N
MW302.56 g/mol
LogP4.68
Rot. Bonds8

About trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate

trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate (PubChem CID 5366591) has the molecular formula C14H30O3Si2 and a molecular weight of 302.56 g/mol. Its IUPAC name is trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate
PubChem CID5366591
Molecular FormulaC14H30O3Si2
Molecular Weight302.56 g/mol
Exact Mass302.17
IUPAC Nametrimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate
SMILESCCCCC/C=C(\O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C14H30O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h12H,8-11H2,1-7H3/b13-12-
InChIKeyOMNZAEOPUFBTBD-SEYXRHQNSA-N
XLogP4.68
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.56
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(Z)-oct-2-en-2-yl]oxysilane
CID 11275679
[(E)-1-methoxyhept-1-enoxy]-trimethylsilane
CID 11321899
trimethyl(tridec-6-en-7-yloxy)silane
CID 71373988
[(E)-1-ethoxyhept-1-enoxy]-trimethylsilane
CID 12886687
trimethylsilyl (E)-12-methyloctadec-11-enoate
CID 91697180
trimethylsilyl (E)-octadec-11-enoate
CID 5366419
(Z)-2-methoxypentadec-2-enoic acid
CID 87404776
trimethylsilyl (E)-2-propylpent-2-enoate
CID 5352357
1-chlorohex-1-enoxy(trimethyl)silane
CID 139728420
trimethylsilyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
CID 5366427
trimethylsilyl (13Z,16Z)-docosa-13,16-dienoate
CID 91696446
2-acetyloxyhexadec-2-enoic acid
CID 161169864

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate?
The IUPAC name of trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate (CID 5366591) is trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate.
What is the SMILES notation for trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate?
The canonical SMILES for trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate is CCCCC/C=C(\O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate?
The InChIKey is OMNZAEOPUFBTBD-SEYXRHQNSA-N. The full InChI is InChI=1S/C14H30O3Si2/c1-8-9-10-11-12-13(16-18(2,3)4)14(15)17-19(5,6)7/h12H,8-11H2,1-7H3/b13-12-.
What are the key properties of trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate?
trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate has a molecular weight of 302.56 g/mol, XLogP of 4.68, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (Z)-2-trimethylsilyloxyoct-2-enoate is sourced from PubChem (CID 5366591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).