ethenyl acetate;oxasilinane

C8H16O3Si — CID 173450943

IUPACethenyl acetate;oxasilinane
SMILESC1CC[SiH2]OC1.C=COC(C)=O
InChIInChI=1S/C4H6O2.C4H10OSi/c1-3-6-4(2)5;1-2-4-6-5-3-1/h3H,1H2,2H3;1-4,6H2
InChIKeyMPPYFKNWJANIBE-UHFFFAOYSA-N
MW188.30 g/mol
LogP0.99
Rot. Bonds1

About ethenyl acetate;oxasilinane

ethenyl acetate;oxasilinane (PubChem CID 173450943) has the molecular formula C8H16O3Si and a molecular weight of 188.30 g/mol. Its IUPAC name is ethenyl acetate;oxasilinane.

Molecular Properties

Compound Nameethenyl acetate;oxasilinane
PubChem CID173450943
Molecular FormulaC8H16O3Si
Molecular Weight188.30 g/mol
Exact Mass188.09
IUPAC Nameethenyl acetate;oxasilinane
SMILESC1CC[SiH2]OC1.C=COC(C)=O
InChIInChI=1S/C4H6O2.C4H10OSi/c1-3-6-4(2)5;1-2-4-6-5-3-1/h3H,1H2,2H3;1-4,6H2
InChIKeyMPPYFKNWJANIBE-UHFFFAOYSA-N
XLogP0.99
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

ethenoxyethene;oxasilinane
CID 173109752
ethene;ethenyl acetate;hydrofluoride
CID 158693082
ethenyl acetate
CID 7904
CID 22770250
CID 22770250
oxasilinane;platinum
CID 173178269
dihydroxy(oxo)phosphanium;oxasilinane
CID 173075218
oxasilinane;propanedioic acid
CID 173162468
ethenyl acetate;formic acid
CID 175608061
ethenyl acetate;methoxyethene
CID 18921270
carbonofluoridic acid;ethenyl acetate
CID 157176220
dichloromethane;ethenyl acetate
CID 86614662
ethanol;ethenyl acetate
CID 87099759

Frequently Asked Questions

What is the IUPAC name of ethenyl acetate;oxasilinane?
The IUPAC name of ethenyl acetate;oxasilinane (CID 173450943) is ethenyl acetate;oxasilinane.
What is the SMILES notation for ethenyl acetate;oxasilinane?
The canonical SMILES for ethenyl acetate;oxasilinane is C1CC[SiH2]OC1.C=COC(C)=O.
What is the InChIKey of ethenyl acetate;oxasilinane?
The InChIKey is MPPYFKNWJANIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O2.C4H10OSi/c1-3-6-4(2)5;1-2-4-6-5-3-1/h3H,1H2,2H3;1-4,6H2.
What are the key properties of ethenyl acetate;oxasilinane?
ethenyl acetate;oxasilinane has a molecular weight of 188.30 g/mol, XLogP of 0.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl acetate;oxasilinane is sourced from PubChem (CID 173450943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).