trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate

C11H24O3Si2 — CID 5366611

IUPACtrimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate
SMILESCC/C(=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si2/c1-8-10(13-15(2,3)4)9-11(12)14-16(5,6)7/h9H,8H2,1-7H3/b10-9-
InChIKeyJTLUJJMBZMUDAC-KTKRTIGZSA-N
MW260.48 g/mol
LogP3.51
Rot. Bonds5

About trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate

trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate (PubChem CID 5366611) has the molecular formula C11H24O3Si2 and a molecular weight of 260.48 g/mol. Its IUPAC name is trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate
PubChem CID5366611
Molecular FormulaC11H24O3Si2
Molecular Weight260.48 g/mol
Exact Mass260.13
IUPAC Nametrimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate
SMILESCC/C(=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si2/c1-8-10(13-15(2,3)4)9-11(12)14-16(5,6)7/h9H,8H2,1-7H3/b10-9-
InChIKeyJTLUJJMBZMUDAC-KTKRTIGZSA-N
XLogP3.51
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.48
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}

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Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate?
The IUPAC name of trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate (CID 5366611) is trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate.
What is the SMILES notation for trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate?
The canonical SMILES for trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate is CC/C(=C/C(=O)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate?
The InChIKey is JTLUJJMBZMUDAC-KTKRTIGZSA-N. The full InChI is InChI=1S/C11H24O3Si2/c1-8-10(13-15(2,3)4)9-11(12)14-16(5,6)7/h9H,8H2,1-7H3/b10-9-.
What are the key properties of trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate?
trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate has a molecular weight of 260.48 g/mol, XLogP of 3.51, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (Z)-3-trimethylsilyloxypent-2-enoate is sourced from PubChem (CID 5366611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).