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

Details

Stereochemistry RACEMIC
Molecular Formula C11H15NO.ClH
Molecular Weight 213.704
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-APDB hydrochloride

SMILES

Cl.CC(N)CC1=C2OCCC2=CC=C1

InChI

InChIKey=GGAPWFVQDNLIBR-UHFFFAOYSA-N
InChI=1S/C11H15NO.ClH/c1-8(12)7-10-4-2-3-9-5-6-13-11(9)10;/h2-4,8H,5-7,12H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C11H15NO
Molecular Weight 177.2429
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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 Wed Apr 02 17:25:18 GMT 2025
Edited
by admin
on Wed Apr 02 17:25:18 GMT 2025
Record UNII
C4KA5T4W9H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-APDB hydrochloride
Common Name English
2,3-Dihydro-?-methyl-7-benzofuranethanamine monohydrochloride
Preferred Name English
7-Benzofuranethanamine, 2,3-dihydro-?-methyl-, hydrochloride (1:1)
Systematic Name English
?-methyl-7-benzofuranethanamine,monohydrochloride
Systematic Name English
Code System Code Type Description
CAS
2736643-47-1
Created by admin on Wed Apr 02 17:25:18 GMT 2025 , Edited by admin on Wed Apr 02 17:25:18 GMT 2025
PRIMARY
PUBCHEM
137699802
Created by admin on Wed Apr 02 17:25:18 GMT 2025 , Edited by admin on Wed Apr 02 17:25:18 GMT 2025
PRIMARY
FDA UNII
C4KA5T4W9H
Created by admin on Wed Apr 02 17:25:18 GMT 2025 , Edited by admin on Wed Apr 02 17:25:18 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE