1,2-Benzenediol, 4-[(1R,2S)-1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride (1:1), rel-

CAS Registry Number®

2576-92-3

CAS Name

1,2-Benzenediol, 4-[(1R,2S)-1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride (1:1), rel-

Molecular Formula

C13H21NO3.ClH

Cite this Page

1,2-Benzenediol, 4-[(1R,2S)-1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride (1:1), rel-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2576-92-3 (retrieved 2024-11-22) (CAS RN: 2576-92-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    212-213 °C (decomp)

Source(s)

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

Other Names and Identifiers

InChI

InChI=1/C13H21NO3.ClH/c1-4-10(14-8(2)3)13(17)9-5-6-11(15)12(16)7-9;/h5-8,10,13-17H,4H2,1-3H3;1H/t10-,13+;/s2

InChIKey

InChIKey=MUFDLGGSOCHQOC-QYRMSZQQNA-N

SMILES

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

Canonical SMILES

Cl.OC1=CC=C(C=C1O)C(O)C(NC(C)C)CC

Other Names for this Substance

  • 1,2-Benzenediol, 4-[(1R,2S)-1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride (1:1), rel-
  • Benzyl alcohol, 3,4-dihydroxy-α-[1-(isopropylamino)propyl]-, hydrochloride, (±)-
  • 1,2-Benzenediol, 4-[1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride, (R*,S*)-(±)-
  • 1,2-Benzenediol, 4-[1-hydroxy-2-[(1-methylethyl)amino]butyl]-, hydrochloride, (R*,S*)-
  • dl-Isoetharine hydrochloride

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Deleted or Replaced CAS Registry Numbers

20839-00-3

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