[diacetyloxy(ethoxy)silyl] acetate

C8H14O7Si — CID 12025413

IUPAC[diacetyloxy(ethoxy)silyl] acetate
SMILESCCO[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C8H14O7Si/c1-5-12-16(13-6(2)9,14-7(3)10)15-8(4)11/h5H2,1-4H3
InChIKeySMBUPLOPBFCDOG-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.15
Rot. Bonds5

About [diacetyloxy(ethoxy)silyl] acetate

[diacetyloxy(ethoxy)silyl] acetate (PubChem CID 12025413) has the molecular formula C8H14O7Si and a molecular weight of 250.28 g/mol. Its IUPAC name is [diacetyloxy(ethoxy)silyl] acetate.

Molecular Properties

Compound Name[diacetyloxy(ethoxy)silyl] acetate
PubChem CID12025413
Molecular FormulaC8H14O7Si
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name[diacetyloxy(ethoxy)silyl] acetate
SMILESCCO[Si](OC(C)=O)(OC(C)=O)OC(C)=O
InChIInChI=1S/C8H14O7Si/c1-5-12-16(13-6(2)9,14-7(3)10)15-8(4)11/h5H2,1-4H3
InChIKeySMBUPLOPBFCDOG-UHFFFAOYSA-N
XLogP0.15
TPSA88.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

CID 87594616
CID 87594616
[ethoxy(dihydroxy)silyl] acetate
CID 138401647
triacetyloxysilyl propanoate
CID 139651068
CID 159416386
CID 159416386
triethoxysilyl 2-chloro-2,2-difluoroacetate
CID 23523584
[acetyloxy(diethoxy)silyl]methyl 2-methylprop-2-enoate
CID 22457247
triethyl (1-methoxy-2-methylprop-1-enyl) silicate
CID 21245405
(acetyloxy-ethyl-methoxysilyl) acetate
CID 18952615
1-triethoxysilylpropan-2-one
CID 174838810
acetaldehyde;tetraethyl silicate
CID 174865015
triethoxysilyl N-propylidenecarbamate
CID 174573064
triethoxysilyl 3,3-bis(sulfanyl)pentanoate
CID 87593886

Frequently Asked Questions

What is the IUPAC name of [diacetyloxy(ethoxy)silyl] acetate?
The IUPAC name of [diacetyloxy(ethoxy)silyl] acetate (CID 12025413) is [diacetyloxy(ethoxy)silyl] acetate.
What is the SMILES notation for [diacetyloxy(ethoxy)silyl] acetate?
The canonical SMILES for [diacetyloxy(ethoxy)silyl] acetate is CCO[Si](OC(C)=O)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(ethoxy)silyl] acetate?
The InChIKey is SMBUPLOPBFCDOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O7Si/c1-5-12-16(13-6(2)9,14-7(3)10)15-8(4)11/h5H2,1-4H3.
What are the key properties of [diacetyloxy(ethoxy)silyl] acetate?
[diacetyloxy(ethoxy)silyl] acetate has a molecular weight of 250.28 g/mol, XLogP of 0.15, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(ethoxy)silyl] acetate is sourced from PubChem (CID 12025413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).