[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate

C11H16O8Si — CID 151148002

IUPAC[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate
SMILESC=CC(=O)OC(C)C(=O)O[Si](C)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H16O8Si/c1-6-10(14)16-7(2)11(15)19-20(5,17-8(3)12)18-9(4)13/h6-7H,1H2,2-5H3
InChIKeyMXPQALUJORBCCI-UHFFFAOYSA-N
MW304.33 g/mol
LogP0.34
Rot. Bonds6

About [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate

[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate (PubChem CID 151148002) has the molecular formula C11H16O8Si and a molecular weight of 304.33 g/mol. Its IUPAC name is [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate.

Molecular Properties

Compound Name[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate
PubChem CID151148002
Molecular FormulaC11H16O8Si
Molecular Weight304.33 g/mol
Exact Mass304.06
IUPAC Name[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate
SMILESC=CC(=O)OC(C)C(=O)O[Si](C)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H16O8Si/c1-6-10(14)16-7(2)11(15)19-20(5,17-8(3)12)18-9(4)13/h6-7H,1H2,2-5H3
InChIKeyMXPQALUJORBCCI-UHFFFAOYSA-N
XLogP0.34
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

1-triacetyloxysilylethyl prop-2-enoate
CID 19827247
3,4-dimethylpent-3-en-2-yl prop-2-enoate
CID 175606841
2-bromoethyl 2-prop-2-enoyloxypropanoate
CID 121344446
(2-ethenoxy-2-oxoethyl) 2-prop-2-enoyloxypropanoate
CID 19748653
lithium 2-prop-2-enoyloxypropanoate
CID 157433958
1-acetyloxypropan-2-yl prop-2-enoate
CID 87413306
3,5-dioxohexan-2-yl prop-2-enoate
CID 20532556
2-[diacetyloxy(methyl)silyl]ethyl prop-2-enoate
CID 154136555
1-(1-prop-2-enoyloxyethoxy)ethyl prop-2-enoate
CID 18008699
(1-hydroxy-2-methylpropyl) prop-2-enoate
CID 23103213
1-dimethylarsanylethyl prop-2-enoate
CID 87979584
1-sulfamoylethyl prop-2-enoate
CID 19880963

Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate?
The IUPAC name of [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate (CID 151148002) is [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate.
What is the SMILES notation for [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate?
The canonical SMILES for [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate is C=CC(=O)OC(C)C(=O)O[Si](C)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate?
The InChIKey is MXPQALUJORBCCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O8Si/c1-6-10(14)16-7(2)11(15)19-20(5,17-8(3)12)18-9(4)13/h6-7H,1H2,2-5H3.
What are the key properties of [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate?
[diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate has a molecular weight of 304.33 g/mol, XLogP of 0.34, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(methyl)silyl] 2-prop-2-enoyloxypropanoate is sourced from PubChem (CID 151148002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).