5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid

C11H24O5Si — CID 22385435

IUPAC5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid
SMILESCO[Si](CCCCC(=O)O)(OC)OC(C)(C)C
InChIInChI=1S/C11H24O5Si/c1-11(2,3)16-17(14-4,15-5)9-7-6-8-10(12)13/h6-9H2,1-5H3,(H,12,13)
InChIKeyUNQXYZQSSDFSHK-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.29
Rot. Bonds8

About 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid

5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid (PubChem CID 22385435) has the molecular formula C11H24O5Si and a molecular weight of 264.39 g/mol. Its IUPAC name is 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid.

Molecular Properties

Compound Name5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid
PubChem CID22385435
Molecular FormulaC11H24O5Si
Molecular Weight264.39 g/mol
Exact Mass264.14
IUPAC Name5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid
SMILESCO[Si](CCCCC(=O)O)(OC)OC(C)(C)C
InChIInChI=1S/C11H24O5Si/c1-11(2,3)16-17(14-4,15-5)9-7-6-8-10(12)13/h6-9H2,1-5H3,(H,12,13)
InChIKeyUNQXYZQSSDFSHK-UHFFFAOYSA-N
XLogP2.29
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid?
The IUPAC name of 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid (CID 22385435) is 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid.
What is the SMILES notation for 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid?
The canonical SMILES for 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid is CO[Si](CCCCC(=O)O)(OC)OC(C)(C)C.
What is the InChIKey of 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid?
The InChIKey is UNQXYZQSSDFSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O5Si/c1-11(2,3)16-17(14-4,15-5)9-7-6-8-10(12)13/h6-9H2,1-5H3,(H,12,13).
What are the key properties of 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid?
5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid has a molecular weight of 264.39 g/mol, XLogP of 2.29, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[dimethoxy-[(2-methylpropan-2-yl)oxy]silyl]pentanoic acid is sourced from PubChem (CID 22385435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).