ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate

C11H24O3Si — CID 159600204

IUPACethyl 2-[methoxy-di(propan-2-yl)silyl]acetate
SMILESCCOC(=O)C[Si](OC)(C(C)C)C(C)C
InChIInChI=1S/C11H24O3Si/c1-7-14-11(12)8-15(13-6,9(2)3)10(4)5/h9-10H,7-8H2,1-6H3
InChIKeyXQYWBMDPNSSMHG-UHFFFAOYSA-N
MW232.40 g/mol
LogP2.96
Rot. Bonds6

About ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate

ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate (PubChem CID 159600204) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate.

Molecular Properties

Compound Nameethyl 2-[methoxy-di(propan-2-yl)silyl]acetate
PubChem CID159600204
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Nameethyl 2-[methoxy-di(propan-2-yl)silyl]acetate
SMILESCCOC(=O)C[Si](OC)(C(C)C)C(C)C
InChIInChI=1S/C11H24O3Si/c1-7-14-11(12)8-15(13-6,9(2)3)10(4)5/h9-10H,7-8H2,1-6H3
InChIKeyXQYWBMDPNSSMHG-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-[dimethyl(propan-2-yl)silyl]acetate
CID 102437234
ethyl (3R)-3-methylpentanoate
CID 7567160
ethyl 6-amino-3,4-dimethyl-6-oxohexanoate
CID 59188853
methoxy-[[methoxy-di(propan-2-yl)silyl]methyl]-di(propan-2-yl)silane
CID 87144334
diethyl propanedioate;3-O-ethyl 1-O-methyl propanedioate
CID 91497468
CID 119097783
CID 119097783
ethyl (3R)-3-methyl-4-oxopentanoate
CID 14870757
ethyl (4S)-3,4-dihydroxypentanoate
CID 156690497
diethyl propanedioate;3-methylpentane
CID 174912983
ethyl 2-propan-2-yloxyacetate
CID 537908
ethyl 3-(dimethylamino)butanoate
CID 3020377
ethyl 3-[(4-ethoxy-4-oxobutan-2-yl)amino]butanoate
CID 121011286

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate?
The IUPAC name of ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate (CID 159600204) is ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate.
What is the SMILES notation for ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate?
The canonical SMILES for ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate is CCOC(=O)C[Si](OC)(C(C)C)C(C)C.
What is the InChIKey of ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate?
The InChIKey is XQYWBMDPNSSMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-7-14-11(12)8-15(13-6,9(2)3)10(4)5/h9-10H,7-8H2,1-6H3.
What are the key properties of ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate?
ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate has a molecular weight of 232.40 g/mol, XLogP of 2.96, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[methoxy-di(propan-2-yl)silyl]acetate is sourced from PubChem (CID 159600204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).