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Details

Stereochemistry ACHIRAL
Molecular Formula C13H17NO2.BrH
Molecular Weight 300.192
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Morpholin-4-yl-1-phenylpropan-1-one hydrobromide

SMILES

Br.O=C(CCN1CCOCC1)C2=CC=CC=C2

InChI

InChIKey=KZWPLLQMJPTVPP-UHFFFAOYSA-N
InChI=1S/C13H17NO2.BrH/c15-13(12-4-2-1-3-5-12)6-7-14-8-10-16-11-9-14;/h1-5H,6-11H2;1H

HIDE SMILES / InChI

Molecular Formula C13H17NO2
Molecular Weight 219.2796
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula BrH
Molecular Weight 80.912
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 Wed Apr 02 19:56:36 GMT 2025
Edited
by admin
on Wed Apr 02 19:56:36 GMT 2025
Record UNII
A7BM8U2FC9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Morpholin-4-yl-1-phenylpropan-1-one hydrobromide
Systematic Name English
1-Propanone, 3-(4-morpholinyl)-1-phenyl-, hydrobromide
Preferred Name English
1-Propanone, 3-(4-morpholinyl)-1-phenyl-, hydrobromide (1:1)
Systematic Name English
3-(Morpholin-4-yl)-1-phenylpropan-1-one hydrobromide
Systematic Name English
Code System Code Type Description
PUBCHEM
12273751
Created by admin on Wed Apr 02 19:56:36 GMT 2025 , Edited by admin on Wed Apr 02 19:56:36 GMT 2025
PRIMARY
CAS
5424-58-8
Created by admin on Wed Apr 02 19:56:36 GMT 2025 , Edited by admin on Wed Apr 02 19:56:36 GMT 2025
PRIMARY
EPA CompTox
DTXSID10483542
Created by admin on Wed Apr 02 19:56:36 GMT 2025 , Edited by admin on Wed Apr 02 19:56:36 GMT 2025
PRIMARY
FDA UNII
A7BM8U2FC9
Created by admin on Wed Apr 02 19:56:36 GMT 2025 , Edited by admin on Wed Apr 02 19:56:36 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE