4-Hydroxybupropion

CAS Registry Number®

78800-57-4

CAS Name

4-Hydroxybupropion

Molecular Formula

C13H18ClNO2

Molecular Mass

255.74

Cite this Page

4-Hydroxybupropion.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78800-57-4 (retrieved 2025-02-02) (CAS RN: 78800-57-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18ClNO2/c1-8(15-13(2,3)4)12(17)9-5-6-11(16)10(14)7-9/h5-8,15-16H,1-4H3

InChIKey

InChIKey=LSZBTGUSYVNVLH-UHFFFAOYSA-N

SMILES

C(C(NC(C)(C)C)C)(=O)C1=CC(Cl)=C(O)C=C1

Canonical SMILES

O=C(C1=CC=C(O)C(Cl)=C1)C(NC(C)(C)C)C

Other Names for this Substance

  • 1-Propanone, 1-(3-chloro-4-hydroxyphenyl)-2-[(1,1-dimethylethyl)amino]-
  • 1-(3-Chloro-4-hydroxyphenyl)-2-[(1,1-dimethylethyl)amino]-1-propanone
  • 4-Hydroxybupropion

Deleted or Replaced CAS Registry Numbers

82793-85-9