methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane

C13H28O3Si2 — CID 174749191

IUPACmethyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane
SMILESC=C(C)C(=O)OC.CC1CC[Si](C)(C)[Si](C)(C)O1
InChIInChI=1S/C8H20OSi2.C5H8O2/c1-8-6-7-10(2,3)11(4,5)9-8;1-4(2)5(6)7-3/h8H,6-7H2,1-5H3;1H2,2-3H3
InChIKeyVJSXNKBEHLUECU-UHFFFAOYSA-N
MW288.54 g/mol
LogP3.52
Rot. Bonds1

About methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane

methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane (PubChem CID 174749191) has the molecular formula C13H28O3Si2 and a molecular weight of 288.54 g/mol. Its IUPAC name is methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane.

Molecular Properties

Compound Namemethyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane
PubChem CID174749191
Molecular FormulaC13H28O3Si2
Molecular Weight288.54 g/mol
Exact Mass288.16
IUPAC Namemethyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane
SMILESC=C(C)C(=O)OC.CC1CC[Si](C)(C)[Si](C)(C)O1
InChIInChI=1S/C8H20OSi2.C5H8O2/c1-8-6-7-10(2,3)11(4,5)9-8;1-4(2)5(6)7-3/h8H,6-7H2,1-5H3;1H2,2-3H3
InChIKeyVJSXNKBEHLUECU-UHFFFAOYSA-N
XLogP3.52
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.54
LogP ≤ 53.52
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'}

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Frequently Asked Questions

What is the IUPAC name of methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane?
The IUPAC name of methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane (CID 174749191) is methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane.
What is the SMILES notation for methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane?
The canonical SMILES for methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane is C=C(C)C(=O)OC.CC1CC[Si](C)(C)[Si](C)(C)O1.
What is the InChIKey of methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane?
The InChIKey is VJSXNKBEHLUECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20OSi2.C5H8O2/c1-8-6-7-10(2,3)11(4,5)9-8;1-4(2)5(6)7-3/h8H,6-7H2,1-5H3;1H2,2-3H3.
What are the key properties of methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane?
methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane has a molecular weight of 288.54 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methylprop-2-enoate;2,2,3,3,6-pentamethyloxadisilinane is sourced from PubChem (CID 174749191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).