[diacetyloxy(pent-1-enyl)silyl] acetate

C11H18O6Si — CID 54207987

IUPAC[diacetyloxy(pent-1-enyl)silyl] acetate
SMILESCCCC=C[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H18O6Si/c1-5-6-7-8-18(15-9(2)12,16-10(3)13)17-11(4)14/h7-8H,5-6H2,1-4H3
InChIKeyPTWZAYHHQVPCJG-UHFFFAOYSA-N
MW274.34 g/mol
LogP1.51
Rot. Bonds6

About [diacetyloxy(pent-1-enyl)silyl] acetate

[diacetyloxy(pent-1-enyl)silyl] acetate (PubChem CID 54207987) has the molecular formula C11H18O6Si and a molecular weight of 274.34 g/mol. Its IUPAC name is [diacetyloxy(pent-1-enyl)silyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(pent-1-enyl)silyl] acetate
PubChem CID54207987
Molecular FormulaC11H18O6Si
Molecular Weight274.34 g/mol
Exact Mass274.09
IUPAC Name[diacetyloxy(pent-1-enyl)silyl] acetate
SMILESCCCC=C[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H18O6Si/c1-5-6-7-8-18(15-9(2)12,16-10(3)13)17-11(4)14/h7-8H,5-6H2,1-4H3
InChIKeyPTWZAYHHQVPCJG-UHFFFAOYSA-N
XLogP1.51
TPSA78.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 51.51
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 [diacetyloxy(pent-1-enyl)silyl] acetate?
The IUPAC name of [diacetyloxy(pent-1-enyl)silyl] acetate (CID 54207987) is [diacetyloxy(pent-1-enyl)silyl] acetate.
What is the SMILES notation for [diacetyloxy(pent-1-enyl)silyl] acetate?
The canonical SMILES for [diacetyloxy(pent-1-enyl)silyl] acetate is CCCC=C[Si](OC(C)=O)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(pent-1-enyl)silyl] acetate?
The InChIKey is PTWZAYHHQVPCJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O6Si/c1-5-6-7-8-18(15-9(2)12,16-10(3)13)17-11(4)14/h7-8H,5-6H2,1-4H3.
What are the key properties of [diacetyloxy(pent-1-enyl)silyl] acetate?
[diacetyloxy(pent-1-enyl)silyl] acetate has a molecular weight of 274.34 g/mol, XLogP of 1.51, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(pent-1-enyl)silyl] acetate is sourced from PubChem (CID 54207987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).