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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H19NO.ClH
Molecular Weight 241.757
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(diethylamino)-1-phenylpropan-1-one hydrochloride

SMILES

Cl.CCN(CC)CCC(=O)C1=CC=CC=C1

InChI

InChIKey=OWSVBXOIOHPZIZ-UHFFFAOYSA-N
InChI=1S/C13H19NO.ClH/c1-3-14(4-2)11-10-13(15)12-8-6-5-7-9-12;/h5-9H,3-4,10-11H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C13H19NO
Molecular Weight 205.2961
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 Sat Dec 16 19:19:00 GMT 2023
Edited
by admin
on Sat Dec 16 19:19:00 GMT 2023
Record UNII
4EX7A5KW2J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(diethylamino)-1-phenylpropan-1-one hydrochloride
Systematic Name English
1-Propanone, 3-(diethylamino)-1-phenyl-, hydrochloride
Systematic Name English
1-Propanone, 3-(diethylamino)-1-phenyl-, hydrochloride (1:1)
Systematic Name English
Propiophenone, 3-(diethylamino)-, hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
4EX7A5KW2J
Created by admin on Sat Dec 16 19:19:00 GMT 2023 , Edited by admin on Sat Dec 16 19:19:00 GMT 2023
PRIMARY
PUBCHEM
13496280
Created by admin on Sat Dec 16 19:19:00 GMT 2023 , Edited by admin on Sat Dec 16 19:19:00 GMT 2023
PRIMARY
CAS
884-12-8
Created by admin on Sat Dec 16 19:19:00 GMT 2023 , Edited by admin on Sat Dec 16 19:19:00 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE