U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C13H13NO2
Molecular Weight 215.2478
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(1-Hydroxy-1-phenylethyl)pyridine 1-oxide

SMILES

CC(O)(C1=CC=CC=C1)C2=CC=CC=[N+]2[O-]

InChI

InChIKey=PNDSFSTXHFPKNJ-UHFFFAOYSA-N
InChI=1S/C13H13NO2/c1-13(15,11-7-3-2-4-8-11)12-9-5-6-10-14(12)16/h2-10,15H,1H3

HIDE SMILES / InChI

Molecular Formula C13H13NO2
Molecular Weight 215.2478
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:19:52 GMT 2025
Edited
by admin
on Wed Apr 02 18:19:52 GMT 2025
Record UNII
RXW33ZWD64
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(1-Oxidopyridin-1-ium-2-yl)-1-phenylethanol
Preferred Name English
2-(1-Hydroxy-1-phenylethyl)pyridine 1-oxide
Systematic Name English
2-Pyridinemethanol, ?-methyl-?-phenyl-, 1-oxide
Systematic Name English
Code System Code Type Description
PUBCHEM
15372710
Created by admin on Wed Apr 02 18:19:52 GMT 2025 , Edited by admin on Wed Apr 02 18:19:52 GMT 2025
PRIMARY
CAS
100393-43-9
Created by admin on Wed Apr 02 18:19:52 GMT 2025 , Edited by admin on Wed Apr 02 18:19:52 GMT 2025
PRIMARY
FDA UNII
RXW33ZWD64
Created by admin on Wed Apr 02 18:19:52 GMT 2025 , Edited by admin on Wed Apr 02 18:19:52 GMT 2025
PRIMARY