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

Details

Stereochemistry RACEMIC
Molecular Formula C11H15NO2.ClH
Molecular Weight 229.703
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BENZODIOXOLYLBUTANAMINE HYDROCHLORIDE

SMILES

Cl.CCC(N)CC1=CC=C2OCOC2=C1

InChI

InChIKey=LFRHMTZYADABJZ-UHFFFAOYSA-N
InChI=1S/C11H15NO2.ClH/c1-2-9(12)5-8-3-4-10-11(6-8)14-7-13-10;/h3-4,6,9H,2,5,7,12H2,1H3;1H

HIDE SMILES / InChI

Approval Year

Name Type Language
1,3-BENZODIOXOLYLBUTANAMINE HYDROCHLORIDE
Systematic Name English
NSC-172188
Preferred Name English
3,4-METHYLENEDIOXY-.ALPHA.-ETHYL-.BETA.-PHENYLETHYLAMINE HYDROCHLORIDE
Systematic Name English
MDB hydrochloride
Common Name English
J hydrochloride
Common Name English
1-(3,4-METHYLENEDIOXYPHENYL)-2-BUTANAMINE HYDROCHLORIDE
Systematic Name English
3,4-methylenedioxybutanphenamine hydrochloride
Common Name English
J (PSYCHEDELIC) hydrochloride
Common Name English
1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIDEUTERIOBUTAN-2-AMINE HYDROCHLORIDE
Systematic Name English
BDB hydrochloride
Common Name English
3,4-methylenedioxy-?-ethylphenethylamine hydrochloride
Common Name English
Code System Code Type Description
FDA UNII
RFD67T622Z
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY
CAS
42542-07-4
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY
CAYMAN
14213
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID00897578
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY
NSC
172188
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY
PUBCHEM
3039210
Created by admin on Mon Mar 31 18:29:34 GMT 2025 , Edited by admin on Mon Mar 31 18:29:34 GMT 2025
PRIMARY