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Details

Stereochemistry ACHIRAL
Molecular Formula 2C9H11NO2.H2O4S
Molecular Weight 428.457
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MDPEA hemisulfate

SMILES

OS(O)(=O)=O.NCCC1=CC=C2OCOC2=C1.NCCC3=CC=C4OCOC4=C3

InChI

InChIKey=UBAJDYDGADCKLW-UHFFFAOYSA-N
InChI=1S/2C9H11NO2.H2O4S/c2*10-4-3-7-1-2-8-9(5-7)12-6-11-8;1-5(2,3)4/h2*1-2,5H,3-4,6,10H2;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula C9H11NO2
Molecular Weight 165.1891
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O4S
Molecular Weight 98.078
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 14:47:33 GMT 2025
Edited
by admin
on Wed Apr 02 14:47:33 GMT 2025
Record UNII
24S4SH8AYR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-MDPEA hemisulfate
Preferred Name English
MDPEA hemisulfate
Common Name English
homopiperonylamine hemisulfate
Common Name English
3,4-Methylenedioxyphenethylamine hemisulfate
Common Name English
1,3-Benzodioxole-5-ethanamine, sulfate (2:1)
Systematic Name English
Code System Code Type Description
CAS
64610-36-2
Created by admin on Wed Apr 02 14:47:33 GMT 2025 , Edited by admin on Wed Apr 02 14:47:33 GMT 2025
PRIMARY
PUBCHEM
85917134
Created by admin on Wed Apr 02 14:47:33 GMT 2025 , Edited by admin on Wed Apr 02 14:47:33 GMT 2025
PRIMARY
FDA UNII
24S4SH8AYR
Created by admin on Wed Apr 02 14:47:33 GMT 2025 , Edited by admin on Wed Apr 02 14:47:33 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE