1H-Indole-3-ethanamine, 7-bromo-5-fluoro-2-methyl-, ethanedioate (1:1)

CAS Registry Number®

1048343-53-8
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CAS Name

1H-Indole-3-ethanamine, 7-bromo-5-fluoro-2-methyl-, ethanedioate (1:1)

Molecular Formula

C11H12BrFN2.C2H2O4

Cite this Page

1H-Indole-3-ethanamine, 7-bromo-5-fluoro-2-methyl-, ethanedioate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1048343-53-8 (retrieved 2024-08-23) (CAS RN: 1048343-53-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12BrFN2.C2H2O4/c1-6-8(2-3-14)9-4-7(13)5-10(12)11(9)15-6;3-1(4)2(5)6/h4-5,15H,2-3,14H2,1H3;(H,3,4)(H,5,6)

InChIKey

InChIKey=ILUFVQPQTOZVRG-UHFFFAOYSA-N

SMILES

C(CN)C=1C=2C(NC1C)=C(Br)C=C(F)C2.C(C(O)=O)(O)=O

Canonical SMILES

O=C(O)C(=O)O.FC=1C=C(Br)C=2NC(=C(C2C1)CCN)C

Other Names for this Substance

  • 1H-Indole-3-ethanamine, 7-bromo-5-fluoro-2-methyl-, ethanedioate (1:1)