trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate

C11H24O3Si2 — CID 5352679

IUPACtrimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate
SMILESC/C(O[Si](C)(C)C)=C(\C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si2/c1-9(10(2)13-15(3,4)5)11(12)14-16(6,7)8/h1-8H3/b10-9-
InChIKeyBDEWTIHUFJXUDU-KTKRTIGZSA-N
MW260.48 g/mol
LogP3.51
Rot. Bonds4

About trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate

trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate (PubChem CID 5352679) has the molecular formula C11H24O3Si2 and a molecular weight of 260.48 g/mol. Its IUPAC name is trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate
PubChem CID5352679
Molecular FormulaC11H24O3Si2
Molecular Weight260.48 g/mol
Exact Mass260.13
IUPAC Nametrimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate
SMILESC/C(O[Si](C)(C)C)=C(\C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H24O3Si2/c1-9(10(2)13-15(3,4)5)11(12)14-16(6,7)8/h1-8H3/b10-9-
InChIKeyBDEWTIHUFJXUDU-KTKRTIGZSA-N
XLogP3.51
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
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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Related Compounds

trimethylsilyl 2-oxopropanoate
CID 554459
trimethylsilyl 2-oxopentanoate
CID 530075
ethane-1,2-diol;trimethylsilyl 2-methylprop-2-enoate
CID 87381259
bis(trimethylsilyl) (E)-2-methylbut-2-enedioate
CID 12598819
trimethylsilyl 2-methylidenebut-3-enoate
CID 19933334
tert-butyl (E)-3-trimethylsilyloxy-2-(1-trimethylsilyloxyethenyl)but-2-enoate
CID 23661406
[(Z)-3,4-dimethylpent-2-en-2-yl]oxy-trimethylsilane
CID 134988122
(4-chloro-3-methylbut-2-en-2-yl)oxy-trimethylsilane
CID 139892135
trimethylsilyl 4,5-dihydroxy-2-methylpent-2-enoate
CID 87381108
trimethylsilyl (E)-3-trimethylsilyloxybut-2-enoate
CID 6427114
trimethylsilyl methylsulfanylformate
CID 57061767
trimethylsilyl 2-methyl-3-trimethylsilyloxyhex-2-eneperoxoate
CID 173459969

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate?
The IUPAC name of trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate (CID 5352679) is trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate.
What is the SMILES notation for trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate?
The canonical SMILES for trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate is C/C(O[Si](C)(C)C)=C(\C)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate?
The InChIKey is BDEWTIHUFJXUDU-KTKRTIGZSA-N. The full InChI is InChI=1S/C11H24O3Si2/c1-9(10(2)13-15(3,4)5)11(12)14-16(6,7)8/h1-8H3/b10-9-.
What are the key properties of trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate?
trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate has a molecular weight of 260.48 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (Z)-2-methyl-3-trimethylsilyloxybut-2-enoate is sourced from PubChem (CID 5352679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).