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Details

Stereochemistry ACHIRAL
Molecular Formula C14H13NO2
Molecular Weight 227.2585
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2-HYDROXYPHENYL)-3-(4-PYRIDINYL)-1-PROPANONE

SMILES

OC1=CC=CC=C1C(=O)CCC2=CC=NC=C2

InChI

InChIKey=NWIXWMAPTKKLID-UHFFFAOYSA-N
InChI=1S/C14H13NO2/c16-13-4-2-1-3-12(13)14(17)6-5-11-7-9-15-10-8-11/h1-4,7-10,16H,5-6H2

HIDE SMILES / InChI

Molecular Formula C14H13NO2
Molecular Weight 227.2585
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:27:19 GMT 2025
Edited
by admin
on Tue Apr 01 20:27:19 GMT 2025
Record UNII
3086SB35E6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4721
Preferred Name English
1-(2-HYDROXYPHENYL)-3-(4-PYRIDINYL)-1-PROPANONE
Systematic Name English
1-PROPANONE, 1-(2-HYDROXYPHENYL)-3-(4-PYRIDINYL)-
Systematic Name English
1-(2-HYDROXYPHENYL)-3-(PYRIDIN-4-YL)PROPAN-1-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID501019574
Created by admin on Tue Apr 01 20:27:19 GMT 2025 , Edited by admin on Tue Apr 01 20:27:19 GMT 2025
PRIMARY
JECFA MONOGRAPH
2134
Created by admin on Tue Apr 01 20:27:19 GMT 2025 , Edited by admin on Tue Apr 01 20:27:19 GMT 2025
PRIMARY
FDA UNII
3086SB35E6
Created by admin on Tue Apr 01 20:27:19 GMT 2025 , Edited by admin on Tue Apr 01 20:27:19 GMT 2025
PRIMARY
CAS
1186004-10-3
Created by admin on Tue Apr 01 20:27:19 GMT 2025 , Edited by admin on Tue Apr 01 20:27:19 GMT 2025
PRIMARY
PUBCHEM
44204990
Created by admin on Tue Apr 01 20:27:19 GMT 2025 , Edited by admin on Tue Apr 01 20:27:19 GMT 2025
PRIMARY