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Details

Stereochemistry ACHIRAL
Molecular Formula C12H19NO2S.ClH
Molecular Weight 277.811
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-TME HYDROCHLORIDE

SMILES

Cl.CCOC1=CC(CCN)=CC(OC)=C1SC

InChI

InChIKey=JMXQSMBITOMJJV-UHFFFAOYSA-N
InChI=1S/C12H19NO2S.ClH/c1-4-15-11-8-9(5-6-13)7-10(14-2)12(11)16-3;/h7-8H,4-6,13H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C12H19NO2S
Molecular Weight 241.35
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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 13:53:17 GMT 2025
Edited
by admin
on Wed Apr 02 13:53:17 GMT 2025
Record UNII
C35MP2CX6C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZENEETHANAMINE, 3-ETHOXY-5-METHOXY-4-(METHYLTHIO)-, HYDROCHLORIDE
Preferred Name English
4-TME HYDROCHLORIDE
Common Name English
BENZENEETHANAMINE, 3-ETHOXY-5-METHOXY-4-(METHYLTHIO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
86250285
Created by admin on Wed Apr 02 13:53:17 GMT 2025 , Edited by admin on Wed Apr 02 13:53:17 GMT 2025
PRIMARY
CAS
90109-48-1
Created by admin on Wed Apr 02 13:53:17 GMT 2025 , Edited by admin on Wed Apr 02 13:53:17 GMT 2025
PRIMARY
FDA UNII
C35MP2CX6C
Created by admin on Wed Apr 02 13:53:17 GMT 2025 , Edited by admin on Wed Apr 02 13:53:17 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE