trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate

C7H16O3Si2 — CID 175051669

IUPACtrimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate
SMILESCC(=C[SiH3])C(=O)OO[Si](C)(C)C
InChIInChI=1S/C7H16O3Si2/c1-6(5-11)7(8)9-10-12(2,3)4/h5H,1-4,11H3
InChIKeyBPOORRKFJOCBFX-UHFFFAOYSA-N
MW204.37 g/mol
LogP0.57
Rot. Bonds3

About trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate

trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate (PubChem CID 175051669) has the molecular formula C7H16O3Si2 and a molecular weight of 204.37 g/mol. Its IUPAC name is trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate.

Molecular Properties

Compound Nametrimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate
PubChem CID175051669
Molecular FormulaC7H16O3Si2
Molecular Weight204.37 g/mol
Exact Mass204.06
IUPAC Nametrimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate
SMILESCC(=C[SiH3])C(=O)OO[Si](C)(C)C
InChIInChI=1S/C7H16O3Si2/c1-6(5-11)7(8)9-10-12(2,3)4/h5H,1-4,11H3
InChIKeyBPOORRKFJOCBFX-UHFFFAOYSA-N
XLogP0.57
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.37
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

trimethylsilyl 3-dimethylsilyl-2-methylprop-2-eneperoxoate
CID 173394840
[dimethyl(trimethylsilyloxy)silyl] 2-methyl-3-silylprop-2-enoate
CID 173352721
bis(trimethylsilyl)methyl 2-methyl-3-silylprop-2-enoate
CID 175386649
ethenyl 2-methyl-3-silylprop-2-enoate
CID 173461885
ethyl 2-methyl-3-silylprop-2-enoate
CID 173118701
trimethylsilyl 2-trimethylsilylethaneperoxoate
CID 22179028
trimethylsilyl 2-methyl-3-trimethylsilyloxyhex-2-eneperoxoate
CID 173459969
methane;2-methyl-3-silylprop-2-enoic acid
CID 173490193
[dimethyl-[1-tris(trimethylsilyloxy)silyloxyethyl]silyl] 2-methyl-4-silylhex-2-eneperoxoate
CID 174052205
trimethylsilyl (E)-3-phenylprop-2-eneperoxoate
CID 22561457
[(E)-2-methylbut-2-enoyl]peroxycarbonyl (E)-2-methylbut-2-eneperoxoate
CID 140987479
bis(trimethylsilyl) (E)-2-methylbut-2-enedioate
CID 12598819

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate?
The IUPAC name of trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate (CID 175051669) is trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate.
What is the SMILES notation for trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate?
The canonical SMILES for trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate is CC(=C[SiH3])C(=O)OO[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate?
The InChIKey is BPOORRKFJOCBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3Si2/c1-6(5-11)7(8)9-10-12(2,3)4/h5H,1-4,11H3.
What are the key properties of trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate?
trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate has a molecular weight of 204.37 g/mol, XLogP of 0.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-methyl-3-silylprop-2-eneperoxoate is sourced from PubChem (CID 175051669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).