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Details

Stereochemistry RACEMIC
Molecular Formula C11H15NO2
Molecular Weight 193.2423
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BENZODIOXOLYLBUTANAMINE

SMILES

CCC(N)CC1=CC2=C(OCO2)C=C1

InChI

InChIKey=VHMRXGAIDDCGDU-UHFFFAOYSA-N
InChI=1S/C11H15NO2/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

HIDE SMILES / InChI

Molecular Formula C11H15NO2
Molecular Weight 193.2423
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:11:21 GMT 2023
Edited
by admin
on Sat Dec 16 11:11:21 GMT 2023
Record UNII
CM58WOT28Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BENZODIOXOLYLBUTANAMINE
Common Name English
BDB
Common Name English
1-(3,4-METHYLENEDIOXYPHENYL)-2-BUTANAMINE
Systematic Name English
J (PSYCHEDELIC)
Common Name English
.ALPHA.-ETHYL-1,3-BENZODIOXOLE-5-ETHANAMINE
Systematic Name English
3,4-methylenedioxy-α-ethylphenethylamine
Systematic Name English
MDB
Common Name English
1-(1',3'-BENZODIOXOL-5'-YL)-2-BUTANAMINE
Systematic Name English
J
Common Name English
1,3-BENZODIOXOLE-5-ETHANAMINE, .ALPHA.-ETHYL-
Systematic Name English
3,4-METHYLENEDIOXYBUTANPHENAMINE
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA PiHKAL
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
Code System Code Type Description
CAS
107447-03-0
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
PRIMARY
WIKIPEDIA
1,3-BENZODIOXOLYLBUTANAMINE
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
PRIMARY
PUBCHEM
129870
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
PRIMARY
FDA UNII
CM58WOT28Y
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
PRIMARY
EPA CompTox
DTXSID30910325
Created by admin on Sat Dec 16 11:11:21 GMT 2023 , Edited by admin on Sat Dec 16 11:11:21 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY