(acetyloxy-chloro-ethenylsilyl) acetate

C6H9ClO4Si — CID 19905094

IUPAC(acetyloxy-chloro-ethenylsilyl) acetate
SMILESC=C[Si](Cl)(OC(C)=O)OC(C)=O
InChIInChI=1S/C6H9ClO4Si/c1-4-12(7,10-5(2)8)11-6(3)9/h4H,1H2,2-3H3
InChIKeyYPXQCRHLJBFHAZ-UHFFFAOYSA-N
MW208.67 g/mol
LogP1.02
Rot. Bonds3

About (acetyloxy-chloro-ethenylsilyl) acetate

(acetyloxy-chloro-ethenylsilyl) acetate (PubChem CID 19905094) has the molecular formula C6H9ClO4Si and a molecular weight of 208.67 g/mol. Its IUPAC name is (acetyloxy-chloro-ethenylsilyl) acetate.

Molecular Properties

Compound Name(acetyloxy-chloro-ethenylsilyl) acetate
PubChem CID19905094
Molecular FormulaC6H9ClO4Si
Molecular Weight208.67 g/mol
Exact Mass208.00
IUPAC Name(acetyloxy-chloro-ethenylsilyl) acetate
SMILESC=C[Si](Cl)(OC(C)=O)OC(C)=O
InChIInChI=1S/C6H9ClO4Si/c1-4-12(7,10-5(2)8)11-6(3)9/h4H,1H2,2-3H3
InChIKeyYPXQCRHLJBFHAZ-UHFFFAOYSA-N
XLogP1.02
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.67
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (acetyloxy-chloro-ethenylsilyl) acetate?
The IUPAC name of (acetyloxy-chloro-ethenylsilyl) acetate (CID 19905094) is (acetyloxy-chloro-ethenylsilyl) acetate.
What is the SMILES notation for (acetyloxy-chloro-ethenylsilyl) acetate?
The canonical SMILES for (acetyloxy-chloro-ethenylsilyl) acetate is C=C[Si](Cl)(OC(C)=O)OC(C)=O.
What is the InChIKey of (acetyloxy-chloro-ethenylsilyl) acetate?
The InChIKey is YPXQCRHLJBFHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClO4Si/c1-4-12(7,10-5(2)8)11-6(3)9/h4H,1H2,2-3H3.
What are the key properties of (acetyloxy-chloro-ethenylsilyl) acetate?
(acetyloxy-chloro-ethenylsilyl) acetate has a molecular weight of 208.67 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (acetyloxy-chloro-ethenylsilyl) acetate is sourced from PubChem (CID 19905094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).