trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate

C10H22O6Si — CID 175435798

IUPACtrimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate
SMILESCO[Si](OC)(OC)OC(=O)C(C)OC(C)(C)C
InChIInChI=1S/C10H22O6Si/c1-8(15-10(2,3)4)9(11)16-17(12-5,13-6)14-7/h8H,1-7H3
InChIKeyIJSXRHKFMGXJBF-UHFFFAOYSA-N
MW266.37 g/mol
LogP1.11
Rot. Bonds6

About trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate

trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate (PubChem CID 175435798) has the molecular formula C10H22O6Si and a molecular weight of 266.37 g/mol. Its IUPAC name is trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate.

Molecular Properties

Compound Nametrimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate
PubChem CID175435798
Molecular FormulaC10H22O6Si
Molecular Weight266.37 g/mol
Exact Mass266.12
IUPAC Nametrimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate
SMILESCO[Si](OC)(OC)OC(=O)C(C)OC(C)(C)C
InChIInChI=1S/C10H22O6Si/c1-8(15-10(2,3)4)9(11)16-17(12-5,13-6)14-7/h8H,1-7H3
InChIKeyIJSXRHKFMGXJBF-UHFFFAOYSA-N
XLogP1.11
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate?
The IUPAC name of trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate (CID 175435798) is trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate.
What is the SMILES notation for trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate?
The canonical SMILES for trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate is CO[Si](OC)(OC)OC(=O)C(C)OC(C)(C)C.
What is the InChIKey of trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate?
The InChIKey is IJSXRHKFMGXJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O6Si/c1-8(15-10(2,3)4)9(11)16-17(12-5,13-6)14-7/h8H,1-7H3.
What are the key properties of trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate?
trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate has a molecular weight of 266.37 g/mol, XLogP of 1.11, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxysilyl 2-[(2-methylpropan-2-yl)oxy]propanoate is sourced from PubChem (CID 175435798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).