HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)oxazole-4-carboxylic acid

HCID 67323977
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)c1coc(-c2noc(C(F)(F)F)n2)n1
InChIKey
HLUICFILNBEKEU-UHFFFAOYSA-N
Molecular formula
C7H2F3N3O4
Average molar mass
249.1 g/mol

Names & identifiers

Preferred name
2-(5-(Trifluoromethyl)-1,2,4-oxadiazol-3-yl)oxazole-4-carboxylic acid
IUPAC
2-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]-1,3-oxazole-4-carboxylic acid

Names & synonyms

2-(5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl)oxazole-4-carboxylic acidSCHEMBL2224986

Database identifiers

PubChem CID
67323977

Properties

Computed structural properties

XLogP
1
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
10
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
313

Related reactions

1 records
New reaction record
HRID 1397388 reaction equation
HRID 1397388As reactantuspto-grants-2014_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes