[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate

C12H18O8Si — CID 150072547

IUPAC[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(=O)O[Si](CC)(OC(C)=O)OC(C)=O
InChIInChI=1S/C12H18O8Si/c1-6-21(18-9(4)13,19-10(5)14)20-11(15)7-17-12(16)8(2)3/h2,6-7H2,1,3-5H3
InChIKeyDPOVDTYEYZRFBR-UHFFFAOYSA-N
MW318.35 g/mol
LogP0.73
Rot. Bonds7

About [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate

[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate (PubChem CID 150072547) has the molecular formula C12H18O8Si and a molecular weight of 318.35 g/mol. Its IUPAC name is [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate
PubChem CID150072547
Molecular FormulaC12H18O8Si
Molecular Weight318.35 g/mol
Exact Mass318.08
IUPAC Name[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(=O)O[Si](CC)(OC(C)=O)OC(C)=O
InChIInChI=1S/C12H18O8Si/c1-6-21(18-9(4)13,19-10(5)14)20-11(15)7-17-12(16)8(2)3/h2,6-7H2,1,3-5H3
InChIKeyDPOVDTYEYZRFBR-UHFFFAOYSA-N
XLogP0.73
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 50.73
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

[diacetyloxy(ethyl)silyl] acetate;2-methylprop-2-enamide
CID 174431894
[2-[2-(2-methylprop-2-enoyloxy)acetyl]oxy-2-oxoethyl] 2-methylprop-2-enoate
CID 87168536
2-triacetyloxysilylethyl 2-methylprop-2-enoate
CID 22457265
[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
CID 22457247
[2-[2-[2-(2-methylprop-2-enoyloxy)acetyl]oxyethoxy]-2-oxoethyl] 2-methylprop-2-enoate
CID 58663419
(2-methoxy-2-oxoethyl) 2-methylprop-2-enoate
CID 22289237
ethene;[2-[2-[2-(2-methylprop-2-enoyloxy)acetyl]oxyethoxy]-2-oxoethyl] 2-methylprop-2-enoate
CID 173091400
3-[diacetyloxy(ethyl)silyl]propyl 2-methylprop-2-enoate
CID 139835403
ethyl 2-methylprop-2-enoate
CID 130475774
(acetyloxy-ethyl-methoxysilyl) acetate
CID 18952615
ethane;bis(ethyl 2-methylprop-2-enoate)
CID 146295289
ethyl 2-methylprop-2-enoate;phosphane
CID 159151613

Frequently Asked Questions

What is the IUPAC name of [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate?
The IUPAC name of [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate (CID 150072547) is [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate.
What is the SMILES notation for [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate?
The canonical SMILES for [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCC(=O)O[Si](CC)(OC(C)=O)OC(C)=O.
What is the InChIKey of [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate?
The InChIKey is DPOVDTYEYZRFBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O8Si/c1-6-21(18-9(4)13,19-10(5)14)20-11(15)7-17-12(16)8(2)3/h2,6-7H2,1,3-5H3.
What are the key properties of [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate?
[2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate has a molecular weight of 318.35 g/mol, XLogP of 0.73, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[diacetyloxy(ethyl)silyl]oxy-2-oxoethyl] 2-methylprop-2-enoate is sourced from PubChem (CID 150072547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).