11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate

C18H36O3Si — CID 142567351

IUPAC11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCCCCCCCC[Si](C)(C)OC
InChIInChI=1S/C18H36O3Si/c1-17(2)18(19)21-15-13-11-9-7-6-8-10-12-14-16-22(4,5)20-3/h1,6-16H2,2-5H3
InChIKeyYPFBIPBROYDYFT-UHFFFAOYSA-N
MW328.57 g/mol
LogP5.47
Rot. Bonds14

About 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate

11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate (PubChem CID 142567351) has the molecular formula C18H36O3Si and a molecular weight of 328.57 g/mol. Its IUPAC name is 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
PubChem CID142567351
Molecular FormulaC18H36O3Si
Molecular Weight328.57 g/mol
Exact Mass328.24
IUPAC Name11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCCCCCCCC[Si](C)(C)OC
InChIInChI=1S/C18H36O3Si/c1-17(2)18(19)21-15-13-11-9-7-6-8-10-12-14-16-22(4,5)20-3/h1,6-16H2,2-5H3
InChIKeyYPFBIPBROYDYFT-UHFFFAOYSA-N
XLogP5.47
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.57
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

10-[methoxy(dimethyl)silyl]decyl 2-methylprop-2-enoate
CID 142567352
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 87862843
10-trimethoxysilyldecyl 2-methylprop-2-enoate
CID 14325398
3-[2-[methoxy(dimethyl)silyl]ethyl-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 140912977
12-[iodo(dimethyl)silyl]dodecyl 2-methylprop-2-enoate
CID 156681481
10-[iodo(dimethyl)silyl]decyl 2-methylprop-2-enoate
CID 156681385
14-[iodo(dimethyl)silyl]tetradecyl 2-methylprop-2-enoate
CID 156681283
18-triiodosilyloctadecyl 2-methylprop-2-enoate
CID 156681536
ethene;4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate;6-(2-methylprop-2-enoyloxy)hexyl 2-methylprop-2-enoate
CID 88685309
20-trifluorosilylicosyl 2-methylprop-2-enoate
CID 156681437
17-trichlorosilylheptadecyl 2-methylprop-2-enoate
CID 156681417
7-tribromosilylheptyl 2-methylprop-2-enoate
CID 156681371

Frequently Asked Questions

What is the IUPAC name of 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate?
The IUPAC name of 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate (CID 142567351) is 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate.
What is the SMILES notation for 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate?
The canonical SMILES for 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCCCCCCCCCC[Si](C)(C)OC.
What is the InChIKey of 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate?
The InChIKey is YPFBIPBROYDYFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O3Si/c1-17(2)18(19)21-15-13-11-9-7-6-8-10-12-14-16-22(4,5)20-3/h1,6-16H2,2-5H3.
What are the key properties of 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate?
11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate has a molecular weight of 328.57 g/mol, XLogP of 5.47, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate is sourced from PubChem (CID 142567351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).