[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate

C17H38O5Si2 — CID 151495490

IUPAC[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
SMILESCCO[Si](CC(C)C(=O)O[Si](C)(C(C)C)C(C)C)(OCC)OCC
InChIInChI=1S/C17H38O5Si2/c1-10-19-24(20-11-2,21-12-3)13-16(8)17(18)22-23(9,14(4)5)15(6)7/h14-16H,10-13H2,1-9H3
InChIKeyPPIIZRRABABZJX-UHFFFAOYSA-N
MW378.66 g/mol
LogP4.61
Rot. Bonds12

About [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate

[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate (PubChem CID 151495490) has the molecular formula C17H38O5Si2 and a molecular weight of 378.66 g/mol. Its IUPAC name is [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate.

Molecular Properties

Compound Name[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
PubChem CID151495490
Molecular FormulaC17H38O5Si2
Molecular Weight378.66 g/mol
Exact Mass378.23
IUPAC Name[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
SMILESCCO[Si](CC(C)C(=O)O[Si](C)(C(C)C)C(C)C)(OCC)OCC
InChIInChI=1S/C17H38O5Si2/c1-10-19-24(20-11-2,21-12-3)13-16(8)17(18)22-23(9,14(4)5)15(6)7/h14-16H,10-13H2,1-9H3
InChIKeyPPIIZRRABABZJX-UHFFFAOYSA-N
XLogP4.61
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.66
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[pentyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659456
[butan-2-yl-bis(2-methylpropyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659500
[hexyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659421
[dibutyl(tert-butyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659186
[ditert-butyl(pentyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659210
[ditert-butyl(cyclopentyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659528
[cyclopentyl(dihexyl)silyl] 2-methyl-3-triethoxysilylpropanoate
CID 155659474
1-triethoxysilylpropan-2-amine
CID 10236113
[butan-2-yl-di(propan-2-yl)silyl] 2-methyl-3-trimethoxysilylpropanoate
CID 155659251
[ditert-butyl(propan-2-yl)silyl] 2-methyl-3-trimethoxysilylpropanoate
CID 155659391
(2-methyl-3-triethoxysilylpropyl) 2-methylprop-2-enoate
CID 22597143
triethoxy-(3-ethyl-2-methylpentyl)silane
CID 18696416

Frequently Asked Questions

What is the IUPAC name of [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate?
The IUPAC name of [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate (CID 151495490) is [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate.
What is the SMILES notation for [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate?
The canonical SMILES for [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate is CCO[Si](CC(C)C(=O)O[Si](C)(C(C)C)C(C)C)(OCC)OCC.
What is the InChIKey of [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate?
The InChIKey is PPIIZRRABABZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38O5Si2/c1-10-19-24(20-11-2,21-12-3)13-16(8)17(18)22-23(9,14(4)5)15(6)7/h14-16H,10-13H2,1-9H3.
What are the key properties of [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate?
[methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate has a molecular weight of 378.66 g/mol, XLogP of 4.61, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [methyl-di(propan-2-yl)silyl] 2-methyl-3-triethoxysilylpropanoate is sourced from PubChem (CID 151495490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).