1-[dimethoxy(methyl)silyl]ethyl acetate

C7H16O4Si — CID 88687093

IUPAC1-[dimethoxy(methyl)silyl]ethyl acetate
SMILESCO[Si](C)(OC)C(C)OC(C)=O
InChIInChI=1S/C7H16O4Si/c1-6(8)11-7(2)12(5,9-3)10-4/h7H,1-5H3
InChIKeyLLMWNHBKOPQUEW-UHFFFAOYSA-N
MW192.29 g/mol
LogP0.84
Rot. Bonds4

About 1-[dimethoxy(methyl)silyl]ethyl acetate

1-[dimethoxy(methyl)silyl]ethyl acetate (PubChem CID 88687093) has the molecular formula C7H16O4Si and a molecular weight of 192.29 g/mol. Its IUPAC name is 1-[dimethoxy(methyl)silyl]ethyl acetate.

Molecular Properties

Compound Name1-[dimethoxy(methyl)silyl]ethyl acetate
PubChem CID88687093
Molecular FormulaC7H16O4Si
Molecular Weight192.29 g/mol
Exact Mass192.08
IUPAC Name1-[dimethoxy(methyl)silyl]ethyl acetate
SMILESCO[Si](C)(OC)C(C)OC(C)=O
InChIInChI=1S/C7H16O4Si/c1-6(8)11-7(2)12(5,9-3)10-4/h7H,1-5H3
InChIKeyLLMWNHBKOPQUEW-UHFFFAOYSA-N
XLogP0.84
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[dimethoxy(methyl)silyl]ethyl 2-methylprop-2-enoate
CID 140540481
bis(3-[dimethoxy(methyl)silyl]-5-methylhexane-2,4-dione);platinum(2+)
CID 175720802
propan-2-yl acetate;hydrochloride
CID 87336432
3-[dimethoxy(methyl)silyl]-2-methylbutanoic acid
CID 57291447
2-acetyloxypropyl(203Hg)mercury-203
CID 23724955
methyl acetate;titanium
CID 87665287
1-(2-acetyloxypropylselanyl)propan-2-yl acetate
CID 132988773
N-methoxymethanamine;propan-2-yl acetate
CID 158428721
2-chloropropane;methyl acetate
CID 157293612
(2S)-2-acetyloxypropanoic acid
CID 6326324
[(E,2R,5R)-5-acetyloxyhex-3-en-2-yl] acetate
CID 166437845
1-[dimethoxy(methyl)silyl]ethyl-hydroxy-dimethylsilane
CID 173175499

Frequently Asked Questions

What is the IUPAC name of 1-[dimethoxy(methyl)silyl]ethyl acetate?
The IUPAC name of 1-[dimethoxy(methyl)silyl]ethyl acetate (CID 88687093) is 1-[dimethoxy(methyl)silyl]ethyl acetate.
What is the SMILES notation for 1-[dimethoxy(methyl)silyl]ethyl acetate?
The canonical SMILES for 1-[dimethoxy(methyl)silyl]ethyl acetate is CO[Si](C)(OC)C(C)OC(C)=O.
What is the InChIKey of 1-[dimethoxy(methyl)silyl]ethyl acetate?
The InChIKey is LLMWNHBKOPQUEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O4Si/c1-6(8)11-7(2)12(5,9-3)10-4/h7H,1-5H3.
What are the key properties of 1-[dimethoxy(methyl)silyl]ethyl acetate?
1-[dimethoxy(methyl)silyl]ethyl acetate has a molecular weight of 192.29 g/mol, XLogP of 0.84, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethoxy(methyl)silyl]ethyl acetate is sourced from PubChem (CID 88687093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).