4-(4-(Trifluoromethyl)phenyl)thiazole-2-carboxylic acid
Basic information
- CAS
886366-98-9- Standard SMILES
O=C(O)c1nc(-c2ccc(C(F)(F)F)cc2)cs1- InChIKey
VPHQUMSAFIQECF-UHFFFAOYSA-N- Molecular formula
- C11H6F3NO2S
- Average molar mass
- 273.23 g/mol
- Monoisotopic mass
- 273.00713409
Names & identifiers
- Preferred name
- 4-(4-(Trifluoromethyl)phenyl)thiazole-2-carboxylic acid
- IUPAC
- 4-[4-(trifluoromethyl)phenyl]-1,3-thiazole-2-carboxylic acid
- English name
- 2-Thiazolecarboxylic acid,4-[4-(trifluoromethyl)phenyl]-
- Molecular formula
- C11H6F3NO2S
- Molecular weight
- 273.23
Names & synonyms
886366-98-94-(4-(trifluoromethyl)phenyl)thiazole-2-carboxylic acid2-Thiazolecarboxylic acid, 4-[4-(trifluoromethyl)phenyl]-4-[4-(Trifluoromethyl)phenyl]-1,3-thiazole-2-carboxylic acid2-Thiazolecarboxylicacid, 4-[4-(trifluoromethyl)phenyl]-SCHEMBL4528732DTXSID00695339AKOS015852905AB41437HS-3102A107254-(4-(trifluoromethyl)phenyl)-2-thiazolecarboxylic acid
Show more names
4-(4-(Trifluoromethyl)phenyl)thiazole-2-carboxylic4-[4-(Trifluoromethyl)phenyl]-2-thiazolecarboxylic acid4-[4-(trifluoromethyl)phenyl]-2-Thiazole carbocylic acid2-Thiazolecarboxylic acid,4-[4-(trifluoromethyl)phenyl]-
4-(4-(trifluoromethyl)phenyl)thiazole-2-carboxylicacid
Database identifiers
- CAS
886366-98-9- PubChem CID
- 53404188
- DTXSID
DTXSID00695339
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 316
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Related reactions
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Compound notes
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