[acetyloxy(ethyl)silyl] acetate;styrene

C14H20O4Si — CID 174652424

IUPAC[acetyloxy(ethyl)silyl] acetate;styrene
SMILESC=Cc1ccccc1.CC[SiH](OC(C)=O)OC(C)=O
InChIInChI=1S/C8H8.C6H12O4Si/c1-2-8-6-4-3-5-7-8;1-4-11(9-5(2)7)10-6(3)8/h2-7H,1H2;11H,4H2,1-3H3
InChIKeyXWLGVLZKQDAXAI-UHFFFAOYSA-N
MW280.40 g/mol
LogP2.68
Rot. Bonds4

About [acetyloxy(ethyl)silyl] acetate;styrene

[acetyloxy(ethyl)silyl] acetate;styrene (PubChem CID 174652424) has the molecular formula C14H20O4Si and a molecular weight of 280.40 g/mol. Its IUPAC name is [acetyloxy(ethyl)silyl] acetate;styrene.

Molecular Properties

Compound Name[acetyloxy(ethyl)silyl] acetate;styrene
PubChem CID174652424
Molecular FormulaC14H20O4Si
Molecular Weight280.40 g/mol
Exact Mass280.11
IUPAC Name[acetyloxy(ethyl)silyl] acetate;styrene
SMILESC=Cc1ccccc1.CC[SiH](OC(C)=O)OC(C)=O
InChIInChI=1S/C8H8.C6H12O4Si/c1-2-8-6-4-3-5-7-8;1-4-11(9-5(2)7)10-6(3)8/h2-7H,1H2;11H,4H2,1-3H3
InChIKeyXWLGVLZKQDAXAI-UHFFFAOYSA-N
XLogP2.68
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.40
LogP ≤ 52.68
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

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Frequently Asked Questions

What is the IUPAC name of [acetyloxy(ethyl)silyl] acetate;styrene?
The IUPAC name of [acetyloxy(ethyl)silyl] acetate;styrene (CID 174652424) is [acetyloxy(ethyl)silyl] acetate;styrene.
What is the SMILES notation for [acetyloxy(ethyl)silyl] acetate;styrene?
The canonical SMILES for [acetyloxy(ethyl)silyl] acetate;styrene is C=Cc1ccccc1.CC[SiH](OC(C)=O)OC(C)=O.
What is the InChIKey of [acetyloxy(ethyl)silyl] acetate;styrene?
The InChIKey is XWLGVLZKQDAXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8.C6H12O4Si/c1-2-8-6-4-3-5-7-8;1-4-11(9-5(2)7)10-6(3)8/h2-7H,1H2;11H,4H2,1-3H3.
What are the key properties of [acetyloxy(ethyl)silyl] acetate;styrene?
[acetyloxy(ethyl)silyl] acetate;styrene has a molecular weight of 280.40 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy(ethyl)silyl] acetate;styrene is sourced from PubChem (CID 174652424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).