1-(2-Aminophenyl)-2-chloroethanone-13C8

CAS: 64605-23-8

Ref. TR-A628052

Product Information

• Name: 1-(2-Aminophenyl)-2-chloroethanone-13C8
• Synonyms: 1-(6-amino(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)-2-chloro(1,2-13C2)ethanone, Ethanone, 1-(2-Aminophenyl)-2-Chloro-, 1-(2-Aminophenyl)-2-chloroethanone

Description

Applications 1-(2-Aminophenyl)-2-chloroethanone-13C8 is an intermediate in the synthesis of Indole-3-carboxaldehyde-13C8 (I614993), the labelled version of Indole-3-carboxaldehyde (I615020) which is a tryptophan (T947200) metabolite from Streptomyces staurosporeus and it is chemical constituent from Inula wissmanniana. Indole-3-carboxaldehyde and other tryptophan metabolites play an important role in mammalian gut immune homeostasis.
References Yang, S., et al.: J. Nat. Prod., 60, 44 (1997); Cheng, X. et al.: Chem. Nat. Compd., 49, 815 (2013); Zelante, T., et al,: Immunity, 39, 372 (2013)

• Brand: TRC

Chemical properties

• Molecular weight: 177.549
• Formula: C₈H₈ClNO
• Color/Form: Neat
• InChI: InChI=1S/C8H8ClNO/c9-5-8(11)6-3-1-2-4-7(6)10/h1-4H,5,10H2/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1
• InChI key: InChIKey=HWIRWNKBVWOIGM-LLXNCONNSA-N
• SMILES: N[13c]1[13cH][13cH][13cH][13cH][13c]1[13C](=O)[13CH2]Cl