[acetyloxy(prop-1-enyl)silyl] acetate

C7H12O4Si — CID 57376819

IUPAC[acetyloxy(prop-1-enyl)silyl] acetate
SMILESCC=C[SiH](OC(C)=O)OC(C)=O
InChIInChI=1S/C7H12O4Si/c1-4-5-12(10-6(2)8)11-7(3)9/h4-5,12H,1-3H3
InChIKeyNNUPKGRBJYPLES-UHFFFAOYSA-N
MW188.25 g/mol
LogP0.45
Rot. Bonds3

About [acetyloxy(prop-1-enyl)silyl] acetate

[acetyloxy(prop-1-enyl)silyl] acetate (PubChem CID 57376819) has the molecular formula C7H12O4Si and a molecular weight of 188.25 g/mol. Its IUPAC name is [acetyloxy(prop-1-enyl)silyl] acetate.

Molecular Properties

Compound Name[acetyloxy(prop-1-enyl)silyl] acetate
PubChem CID57376819
Molecular FormulaC7H12O4Si
Molecular Weight188.25 g/mol
Exact Mass188.05
IUPAC Name[acetyloxy(prop-1-enyl)silyl] acetate
SMILESCC=C[SiH](OC(C)=O)OC(C)=O
InChIInChI=1S/C7H12O4Si/c1-4-5-12(10-6(2)8)11-7(3)9/h4-5,12H,1-3H3
InChIKeyNNUPKGRBJYPLES-UHFFFAOYSA-N
XLogP0.45
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.25
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate
CID 175723068
[ethenyl(2-methoxyethoxy)silyl] acetate
CID 175229199
[(E)-prop-1-enyl] acetate
CID 637917
diacetyloxysilyl acetate;N-methylmethanamine
CID 173168005
di(propan-2-yloxy)-prop-1-enylsilane
CID 154087655
dimethylsilyl 2-methylbut-2-enoate
CID 123251992
but-2-en-2-ylsilyl acetate
CID 173050843
acetaldehyde;methane;methyl acetate
CID 157361598
ethenyl acetate
CID 7904
[acetyloxy(trimethylsilyloxy)silyl] acetate
CID 123623987
[acetyloxy(2-aminoethyl)silyl] acetate
CID 173167908
[(Z)-1-acetyloxybut-2-enyl] acetate
CID 5363431

Frequently Asked Questions

What is the IUPAC name of [acetyloxy(prop-1-enyl)silyl] acetate?
The IUPAC name of [acetyloxy(prop-1-enyl)silyl] acetate (CID 57376819) is [acetyloxy(prop-1-enyl)silyl] acetate.
What is the SMILES notation for [acetyloxy(prop-1-enyl)silyl] acetate?
The canonical SMILES for [acetyloxy(prop-1-enyl)silyl] acetate is CC=C[SiH](OC(C)=O)OC(C)=O.
What is the InChIKey of [acetyloxy(prop-1-enyl)silyl] acetate?
The InChIKey is NNUPKGRBJYPLES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O4Si/c1-4-5-12(10-6(2)8)11-7(3)9/h4-5,12H,1-3H3.
What are the key properties of [acetyloxy(prop-1-enyl)silyl] acetate?
[acetyloxy(prop-1-enyl)silyl] acetate has a molecular weight of 188.25 g/mol, XLogP of 0.45, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy(prop-1-enyl)silyl] acetate is sourced from PubChem (CID 57376819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).