[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate

C14H32O5Si3 — CID 118855687

IUPAC[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(O)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H32O5Si3/c1-12(2)14(16)17-10-13(15)11-22(9,18-20(3,4)5)19-21(6,7)8/h13,15H,1,10-11H2,2-9H3
InChIKeyOUSYFXDSWHYKBV-UHFFFAOYSA-N
MW364.66 g/mol
LogP3.24
Rot. Bonds9

About [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate

[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate (PubChem CID 118855687) has the molecular formula C14H32O5Si3 and a molecular weight of 364.66 g/mol. Its IUPAC name is [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate
PubChem CID118855687
Molecular FormulaC14H32O5Si3
Molecular Weight364.66 g/mol
Exact Mass364.16
IUPAC Name[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(O)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H32O5Si3/c1-12(2)14(16)17-10-13(15)11-22(9,18-20(3,4)5)19-21(6,7)8/h13,15H,1,10-11H2,2-9H3
InChIKeyOUSYFXDSWHYKBV-UHFFFAOYSA-N
XLogP3.24
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.66
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[2-hydroxy-4-(methoxy-methyl-trimethylsilyloxysilyl)butyl] 2-methylprop-2-enoate
CID 58512799
[2-hydroxy-3-[3-[methyl-(2-methylprop-2-enoyloxy)-trimethylsilyloxysilyl]propoxy]propyl] 2-methylprop-2-enoate
CID 140749715
[2-hydroxy-3-[1-tris(trimethylsilyloxy)silylpropoxy]propyl] 2-methylprop-2-enoate
CID 22134039
[2-hydroxy-4-[propyl-bis(trimethylsilyloxy)silyl]butyl] 2-methylprop-2-enoate
CID 160516479
[2-hydroxy-3-[1-[methyl-bis(trimethylsilyloxy)silyl]propoxy]propyl] 2-methylprop-2-enoate
CID 87222684
(2-hydroxy-3-methoxypropyl) 2-methylprop-2-enoate
CID 15315335
[2-[3-(2-hydroxyethoxy)propoxy]-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate
CID 87152295
[3-hydroxy-4-(2-methylprop-2-enoyloxy)butyl] 2-methylprop-2-enoate
CID 19428981
(4-amino-2-hydroxy-4-oxobutyl) 2-methylprop-2-enoate
CID 87605994
(2-hydroxy-3-methoxycarbonyloxypropyl) 2-methylprop-2-enoate
CID 139917348
2,3-dihydroxypropyl 2-methylprop-2-enoate;propane
CID 87556862
(2-hydroxy-3-prop-2-enoyloxypropyl) 2-methylprop-2-enoate;methane;prop-2-enamide
CID 160685557

Frequently Asked Questions

What is the IUPAC name of [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate?
The IUPAC name of [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate (CID 118855687) is [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate.
What is the SMILES notation for [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate?
The canonical SMILES for [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCC(O)C[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate?
The InChIKey is OUSYFXDSWHYKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O5Si3/c1-12(2)14(16)17-10-13(15)11-22(9,18-20(3,4)5)19-21(6,7)8/h13,15H,1,10-11H2,2-9H3.
What are the key properties of [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate?
[2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate has a molecular weight of 364.66 g/mol, XLogP of 3.24, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-hydroxy-3-[methyl-bis(trimethylsilyloxy)silyl]propyl] 2-methylprop-2-enoate is sourced from PubChem (CID 118855687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).