U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C12H19N.ClH
Molecular Weight 213.747
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Isopropylamphetamine hydrochloride

SMILES

Cl.CC(C)NC(C)CC1=CC=CC=C1

InChI

InChIKey=JTEZUILSFLCPDP-UHFFFAOYSA-N
InChI=1S/C12H19N.ClH/c1-10(2)13-11(3)9-12-7-5-4-6-8-12;/h4-8,10-11,13H,9H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C12H19N
Molecular Weight 177.286
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
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
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
KZ92F7NHN7
Record Status Validated (UNII)
Record Version