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Ethyl 2-(diethylamino)-4-trifluoromethyl-5-oxazolecarboxylate

HCID 20064751
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)c1oc(N(CC)CC)nc1C(F)(F)F
InChIKey
GXMUCUMEIYNLRZ-UHFFFAOYSA-N
Molecular formula
C11H15F3N2O3
Average molar mass
280.24 g/mol

Names & identifiers

Preferred name
Ethyl 2-(diethylamino)-4-trifluoromethyl-5-oxazolecarboxylate
IUPAC
ethyl 2-(diethylamino)-4-(trifluoromethyl)-1,3-oxazole-5-carboxylate

Names & synonyms

Ethyl 2-(diethylamino)-4-trifluoromethyl-5-oxazolecarboxylateSCHEMBL9750549

Database identifiers

PubChem CID
20064751

Properties

Computed structural properties

XLogP
3
Topological polar surface area
55.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
19
Formal charge
0
Complexity
308

Related reactions

2 records
New reaction record
HRID 359264 reaction equation
HRID 359264As productuspto-grants-1991_03
HRID 823152 reaction equation
HRID 823152As productTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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