bis(trimethylsilyl) (Z)-but-2-enedioate

C10H20O4Si2 — CID 5372912

IUPACbis(trimethylsilyl) (Z)-but-2-enedioate
SMILESC[Si](C)(C)OC(=O)/C=C\C(=O)O[Si](C)(C)C
InChIInChI=1S/C10H20O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H,1-6H3/b8-7-
InChIKeyOITVFMRNHJZOHF-FPLPWBNLSA-N
MW260.44 g/mol
LogP2.30
Rot. Bonds4

About bis(trimethylsilyl) (Z)-but-2-enedioate

bis(trimethylsilyl) (Z)-but-2-enedioate (PubChem CID 5372912) has the molecular formula C10H20O4Si2 and a molecular weight of 260.44 g/mol. Its IUPAC name is bis(trimethylsilyl) (Z)-but-2-enedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) (Z)-but-2-enedioate
PubChem CID5372912
Molecular FormulaC10H20O4Si2
Molecular Weight260.44 g/mol
Exact Mass260.09
IUPAC Namebis(trimethylsilyl) (Z)-but-2-enedioate
SMILESC[Si](C)(C)OC(=O)/C=C\C(=O)O[Si](C)(C)C
InChIInChI=1S/C10H20O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H,1-6H3/b8-7-
InChIKeyOITVFMRNHJZOHF-FPLPWBNLSA-N
XLogP2.30
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.44
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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 bis(trimethylsilyl) (Z)-but-2-enedioate?
The IUPAC name of bis(trimethylsilyl) (Z)-but-2-enedioate (CID 5372912) is bis(trimethylsilyl) (Z)-but-2-enedioate.
What is the SMILES notation for bis(trimethylsilyl) (Z)-but-2-enedioate?
The canonical SMILES for bis(trimethylsilyl) (Z)-but-2-enedioate is C[Si](C)(C)OC(=O)/C=C\C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) (Z)-but-2-enedioate?
The InChIKey is OITVFMRNHJZOHF-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H20O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H,1-6H3/b8-7-.
What are the key properties of bis(trimethylsilyl) (Z)-but-2-enedioate?
bis(trimethylsilyl) (Z)-but-2-enedioate has a molecular weight of 260.44 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) (Z)-but-2-enedioate is sourced from PubChem (CID 5372912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).