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Ethyl 5-[1-(t-butyldimethylsilanyloxy)ethyl]isoxazole-3-carboxylate

HCID 57736274
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1cc(C(C)O[Si](C)(C)C(C)(C)C)on1
InChIKey
PTYVAXUUODPWJN-UHFFFAOYSA-N
Molecular formula
C14H25NO4Si
Average molar mass
299.44 g/mol
Monoisotopic mass
299.15528481

Names & identifiers

Preferred name
Ethyl 5-[1-(t-butyldimethylsilanyloxy)ethyl]isoxazole-3-carboxylate
IUPAC
ethyl 5-[1-[tert-butyl(dimethyl)silyl]oxyethyl]-1,2-oxazole-3-carboxylate

Names & synonyms

SCHEMBL3765251PTYVAXUUODPWJN-UHFFFAOYSA-Nethyl 5-[1-(t-butyldimethylsilanyloxy)ethyl]isoxazole-3-carboxylate

Database identifiers

PubChem CID
57736274

Properties

Computed structural propertiesFilling in

Topological polar surface area
61.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
341

Related reactions

4 records
New reaction record
HRID 302693 reaction equation
HRID 302693As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 949787 reaction equation
HRID 949787As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2261345 reaction equation
HRID 2261345As productuspto-grants-2010_12
HRID 2261346 reaction equation
HRID 2261346As reactantuspto-grants-2010_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes