trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate

C14H32O4Si3 — CID 102059143

IUPACtrimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate
SMILESCOC(C(=O)O[Si](C)(C)C)/C(=C/[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H32O4Si3/c1-16-13(14(15)18-21(8,9)10)12(11-19(2,3)4)17-20(5,6)7/h11,13H,1-10H3/b12-11-
InChIKeyLKKMMQFTDNHFRJ-QXMHVHEDSA-N
MW348.66 g/mol
LogP3.99
Rot. Bonds7

About trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate

trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate (PubChem CID 102059143) has the molecular formula C14H32O4Si3 and a molecular weight of 348.66 g/mol. Its IUPAC name is trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate.

Molecular Properties

Compound Nametrimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate
PubChem CID102059143
Molecular FormulaC14H32O4Si3
Molecular Weight348.66 g/mol
Exact Mass348.16
IUPAC Nametrimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate
SMILESCOC(C(=O)O[Si](C)(C)C)/C(=C/[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H32O4Si3/c1-16-13(14(15)18-21(8,9)10)12(11-19(2,3)4)17-20(5,6)7/h11,13H,1-10H3/b12-11-
InChIKeyLKKMMQFTDNHFRJ-QXMHVHEDSA-N
XLogP3.99
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.66
LogP ≤ 53.99
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'}

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Related Compounds

trimethylsilyl (E)-4-trimethylsilyl-2,3-bis(trimethylsilyloxy)but-3-enoate
CID 14715611
methyl 2-[(2S)-but-3-en-2-yl]oxy-3-[tert-butyl(dimethyl)silyl]oxybut-3-enoate
CID 15350846

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate?
The IUPAC name of trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate (CID 102059143) is trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate.
What is the SMILES notation for trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate?
The canonical SMILES for trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate is COC(C(=O)O[Si](C)(C)C)/C(=C/[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate?
The InChIKey is LKKMMQFTDNHFRJ-QXMHVHEDSA-N. The full InChI is InChI=1S/C14H32O4Si3/c1-16-13(14(15)18-21(8,9)10)12(11-19(2,3)4)17-20(5,6)7/h11,13H,1-10H3/b12-11-.
What are the key properties of trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate?
trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate has a molecular weight of 348.66 g/mol, XLogP of 3.99, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (Z)-2-methoxy-4-trimethylsilyl-3-trimethylsilyloxybut-3-enoate is sourced from PubChem (CID 102059143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).