Isotope Science / Alfa Chemistry

3, 4, 4'- Trichlorocarbanilide-13C6 (Triclocarban-13C6)

Catalog Number ACM1216457769
CAS 1216457-76-9
Structure Structure
Synonyms 3,4,4'-Trichlorocarbanilide-1',2',3',5',6'-13C6, 3-(4-Chlorophenyl-13C6)-1-(3,4-dichlorophenyl)urea, Triclocarban (4-chlorophenyl-13C6)
IUPAC Name 1-(4-chloro(1,2,3,4,5,6-^{13}C_{6})cyclohexa-1,3,5-trien-1-yl)-3-(3,4-dichlorophenyl)urea
Molecular Weight 321.54
Molecular Formula 13C6C7H9Cl3N2O
Canonical SMILES Cl[13c]1[13cH][13cH][13c](NC(=O)Nc2ccc(Cl)c(Cl)c2)[13cH][13cH]1
InChI InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)/i1+1,2+1,3+1,4+1,8+1,9+1
Storage +4 °C
Accurate Mass 319.9982
Format Neat
Shipping Temperature Room temperature
SIL Type Carbon
Unlabeled CAS 101-20-2
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