[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate

C9H14O6Si — CID 175723068

IUPAC[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate
SMILESCC(=O)O[SiH](C=COCC1CO1)OC(C)=O
InChIInChI=1S/C9H14O6Si/c1-7(10)14-16(15-8(2)11)4-3-12-5-9-6-13-9/h3-4,9,16H,5-6H2,1-2H3
InChIKeyFAJPNDJKEJXWRD-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.20
Rot. Bonds6

About [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate

[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate (PubChem CID 175723068) has the molecular formula C9H14O6Si and a molecular weight of 246.29 g/mol. Its IUPAC name is [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate.

Molecular Properties

Compound Name[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate
PubChem CID175723068
Molecular FormulaC9H14O6Si
Molecular Weight246.29 g/mol
Exact Mass246.06
IUPAC Name[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate
SMILESCC(=O)O[SiH](C=COCC1CO1)OC(C)=O
InChIInChI=1S/C9H14O6Si/c1-7(10)14-16(15-8(2)11)4-3-12-5-9-6-13-9/h3-4,9,16H,5-6H2,1-2H3
InChIKeyFAJPNDJKEJXWRD-UHFFFAOYSA-N
XLogP-0.20
TPSA74.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[[(E)-prop-1-enoxy]methyl]oxirane
CID 6436935
2-(pent-1-enoxymethyl)oxirane
CID 54343228
1-(oxiran-2-yl)propan-2-one
CID 15110788
oxiran-2-ylmethyl 3-ethoxy-2-methylprop-2-enoate
CID 175102529
2-methylbut-2-ene;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87813388
oxiran-2-ylmethyl 3-acetyloxypropanoate
CID 21339917
methyl (E)-3-(oxiran-2-ylmethoxy)but-2-enoate
CID 12787162
bis(oxiran-2-ylmethyl) carbonate
CID 13170402
[(2R)-oxiran-2-yl]methyl 2-methylprop-2-enoate
CID 904806
oxiran-2-ylmethyl 2-(oxiran-2-yl)acetate
CID 22381567
2-(oct-1-enoxymethyl)oxirane
CID 57286562
oxiran-2-ylmethyl 2-methylpent-2-enoate
CID 57029570

Frequently Asked Questions

What is the IUPAC name of [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate?
The IUPAC name of [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate (CID 175723068) is [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate.
What is the SMILES notation for [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate?
The canonical SMILES for [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate is CC(=O)O[SiH](C=COCC1CO1)OC(C)=O.
What is the InChIKey of [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate?
The InChIKey is FAJPNDJKEJXWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O6Si/c1-7(10)14-16(15-8(2)11)4-3-12-5-9-6-13-9/h3-4,9,16H,5-6H2,1-2H3.
What are the key properties of [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate?
[acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate has a molecular weight of 246.29 g/mol, XLogP of -0.20, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy-[2-(oxiran-2-ylmethoxy)ethenyl]silyl] acetate is sourced from PubChem (CID 175723068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).