dimethyl 3-trimethylsilyloxypentanedioate

C10H20O5Si — CID 560715

IUPACdimethyl 3-trimethylsilyloxypentanedioate
SMILESCOC(=O)CC(CC(=O)OC)O[Si](C)(C)C
InChIInChI=1S/C10H20O5Si/c1-13-9(11)6-8(7-10(12)14-2)15-16(3,4)5/h8H,6-7H2,1-5H3
InChIKeyBMHHUWIFDYJACM-UHFFFAOYSA-N
MW248.35 g/mol
LogP1.33
Rot. Bonds6

About dimethyl 3-trimethylsilyloxypentanedioate

dimethyl 3-trimethylsilyloxypentanedioate (PubChem CID 560715) has the molecular formula C10H20O5Si and a molecular weight of 248.35 g/mol. Its IUPAC name is dimethyl 3-trimethylsilyloxypentanedioate.

Molecular Properties

Compound Namedimethyl 3-trimethylsilyloxypentanedioate
PubChem CID560715
Molecular FormulaC10H20O5Si
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Namedimethyl 3-trimethylsilyloxypentanedioate
SMILESCOC(=O)CC(CC(=O)OC)O[Si](C)(C)C
InChIInChI=1S/C10H20O5Si/c1-13-9(11)6-8(7-10(12)14-2)15-16(3,4)5/h8H,6-7H2,1-5H3
InChIKeyBMHHUWIFDYJACM-UHFFFAOYSA-N
XLogP1.33
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 dimethyl 3-trimethylsilyloxypentanedioate?
The IUPAC name of dimethyl 3-trimethylsilyloxypentanedioate (CID 560715) is dimethyl 3-trimethylsilyloxypentanedioate.
What is the SMILES notation for dimethyl 3-trimethylsilyloxypentanedioate?
The canonical SMILES for dimethyl 3-trimethylsilyloxypentanedioate is COC(=O)CC(CC(=O)OC)O[Si](C)(C)C.
What is the InChIKey of dimethyl 3-trimethylsilyloxypentanedioate?
The InChIKey is BMHHUWIFDYJACM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5Si/c1-13-9(11)6-8(7-10(12)14-2)15-16(3,4)5/h8H,6-7H2,1-5H3.
What are the key properties of dimethyl 3-trimethylsilyloxypentanedioate?
dimethyl 3-trimethylsilyloxypentanedioate has a molecular weight of 248.35 g/mol, XLogP of 1.33, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 3-trimethylsilyloxypentanedioate is sourced from PubChem (CID 560715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).