Record Information
Version1.0
Creation Date2026-04-03 02:27:05 UTC
Update Date2026-04-03 02:27:05 UTC
Accession NumberCHEM060354
Identification
Common NameN1-[3,5-Bis(trifluoromethyl)phenyl]-2-[4-(trifluoromethyl)benzylidene]hydrazine-1-carboxamide
ClassSmall Molecule
DescriptionN1-[3,5-Bis(trifluoromethyl)phenyl]-2-[4-(trifluoromethyl)benzylidene]hydrazine-1-carboxamide belongs to the n-phenylureas, a subclass of benzene and substituted derivatives within the organic compounds. It is a benzenoid with the chemical formula C17H10F9N3O1.
Contaminant SourcesNot Available
Contaminant TypeNot Available
Chemical Structure
Thumb
SynonymsNot Available
Chemical FormulaC17H10F9N3O1
Average Molecular MassNot Available
Monoisotopic Mass443.068 g/mol
CAS Registry NumberNot Available
IUPAC Name1-[3,5-bis(trifluoromethyl)phenyl]-3-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]urea
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C17H10F9N3O/c18-15(19,20)10-3-1-9(2-4-10)8-27-29-14(30)28-13-6-11(16(21,22)23)5-12(7-13)17(24,25)26/h1-8H,(H2,28,29,30)/b27-8+
InChI KeyYUPIQBUHCKENOA-FLUNURKVSA-N
Chemical Taxonomy
Description belongs to the class of organic compounds known as n-phenylureas. N-phenylureas are compounds containing a N-phenylurea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a urea group.
KingdomOrganic compounds
Super ClassBenzenoids
ClassBenzene and substituted derivatives
Sub ClassN-phenylureas
Direct ParentN-phenylureas
Alternative Parents
Substituents
  • N-phenylurea
  • Trifluoromethylbenzene
  • Semicarbazone
  • Semicarbazide
  • Alkyl fluoride
  • Hydrocarbon derivative
  • Organic oxide
  • Organic oxygen compound
  • Organooxygen compound
  • Organonitrogen compound
  • Organofluoride
  • Organohalogen compound
  • Organic nitrogen compound
  • Carbonyl group
  • Alkyl halide
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External DescriptorsNot Available
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkNot Available
Chemspider IDNot Available
ChEBI IDNot Available
PubChem Compound ID9580640
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available