Record Information
Version1.0
Creation Date2026-04-03 03:31:30 UTC
Update Date2026-04-03 03:31:30 UTC
Accession NumberCHEM060940
Identification
Common NameBk-2C-B
ClassSmall Molecule
DescriptionBk-2C-B is an organic compound with the chemical formula C10H12Br1N1O3. Bk-2C-B belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. It is further classified as an organic oxygen compound and an organooxygen compound.
Contaminant SourcesNot Available
Contaminant TypeNot Available
Chemical Structure
Thumb
Synonyms
ValueSource
2-Amino-1-(4-bromo-2,5-dimethoxyphenyl)ethan-1-oneMeSH
Chemical FormulaC10H12Br1N1O3
Average Molecular MassNot Available
Monoisotopic Mass273.000 g/mol
CAS Registry Number807631-09-0
IUPAC Name2-amino-1-(4-bromo-2,5-dimethoxyphenyl)ethanone
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C10H12BrNO3/c1-14-9-4-7(11)10(15-2)3-6(9)8(13)5-12/h3-4H,5,12H2,1-2H3
InChI KeyHFYJGAIOBIDRPX-UHFFFAOYSA-N
Chemical Taxonomy
Description belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
KingdomOrganic compounds
Super ClassOrganic oxygen compounds
ClassOrganooxygen compounds
Sub ClassCarbonyl compounds
Direct ParentAlkyl-phenylketones
Alternative Parents
Substituents
  • Alkyl-phenylketone
  • P-dimethoxybenzene
  • Dimethoxybenzene
  • Phenoxy compound
  • Anisole
  • Benzoyl
  • Methoxybenzene
  • Aryl alkyl ketone
  • Phenol ether
  • Alkyl aryl ether
  • Bromobenzene
  • Halobenzene
  • Aryl bromide
  • Aryl halide
  • Monocyclic benzene moiety
  • Benzenoid
  • Alpha-aminoketone
  • Ether
  • Primary amine
  • Organic oxide
  • Hydrocarbon derivative
  • Amine
  • Organic nitrogen compound
  • Primary aliphatic amine
  • Organohalogen compound
  • Organobromide
  • Organonitrogen compound
  • 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 ID11288812
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available