Benzeneethanamine, α,α,β-trimethyl-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1)

CAS Registry Number®

22232-55-9

CAS Name

Benzeneethanamine, α,α,β-trimethyl-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1)

Molecular Formula

C11H17N.C4H6O6

Cite this Page

Benzeneethanamine, α,α,β-trimethyl-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22232-55-9 (retrieved 2024-12-23) (CAS RN: 22232-55-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    160-162 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C11H17N.C4H6O6/c1-9(11(2,3)12)10-7-5-4-6-8-10;5-1(3(7)8)2(6)4(9)10/h4-9H,12H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.0/s1

InChIKey

InChIKey=QARISFYEQKFRIJ-WUUYCOTASA-N

SMILES

C(C(C)(C)N)(C)C1=CC=CC=C1.[C@H]([C@@H](C(O)=O)O)(C(O)=O)O

Canonical SMILES

O=C(O)C(O)C(O)C(=O)O.NC(C)(C)C(C=1C=CC=CC1)C

Other Names for this Substance

  • Benzeneethanamine, α,α,β-trimethyl-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1)
  • Phenethylamine, α,α,β-trimethyl-, (±)-, D-tartrate (1:1)
  • Benzeneethanamine, α,α,β-trimethyl-, (±)-, [S-(R*,R*)]-2,3-dihydroxybutanedioate (1:1)
  • Modatrop
  • 2-Phenyl-3-methylbutylamine-(3)-hydrogentartrate

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