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Details

Stereochemistry ACHIRAL
Molecular Formula C9H11NO2.ClH
Molecular Weight 201.65
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-Methylenedioxy-N-methylbenzylamine hydrochloride

SMILES

Cl.CNCC1=CC2=C(OCO2)C=C1

InChI

InChIKey=KBQQSMNMBJRWCS-UHFFFAOYSA-N
InChI=1S/C9H11NO2.ClH/c1-10-5-7-2-3-8-9(4-7)12-6-11-8;/h2-4,10H,5-6H2,1H3;1H

HIDE SMILES / InChI

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

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

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:49:45 GMT 2025
Edited
by admin
on Wed Apr 02 17:49:45 GMT 2025
Record UNII
FZW5CKQ3LP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-Methylenedioxy-N-methylbenzylamine hydrochloride
Systematic Name English
(2H-1,3-Benzodioxol-5-ylmethyl)(methyl)amine hydrochloride
Preferred Name English
1-(1,3-benzodioxol-5-yl)-N-methylmethanamine;hydrochloride
Systematic Name English
1-(Benzo[d][1,3]dioxol-5-yl)-N-methylmethanamine hydrochloride
Systematic Name English
1,3-Benzodioxole-5-methanamine, N-methyl-, hydrochloride
Systematic Name English
1,3-Benzodioxole-5-methanamine, N-methyl-, hydrochloride (1:1)
Systematic Name English
N-Methyl-3,4-(methylenedioxy)benzylamine hydrochloride
Systematic Name English
Code System Code Type Description
CAS
53942-89-5
Created by admin on Wed Apr 02 17:49:45 GMT 2025 , Edited by admin on Wed Apr 02 17:49:45 GMT 2025
PRIMARY
PUBCHEM
17290662
Created by admin on Wed Apr 02 17:49:45 GMT 2025 , Edited by admin on Wed Apr 02 17:49:45 GMT 2025
PRIMARY
FDA UNII
FZW5CKQ3LP
Created by admin on Wed Apr 02 17:49:45 GMT 2025 , Edited by admin on Wed Apr 02 17:49:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID30968745
Created by admin on Wed Apr 02 17:49:45 GMT 2025 , Edited by admin on Wed Apr 02 17:49:45 GMT 2025
PRIMARY
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