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Details

Stereochemistry RACEMIC
Molecular Formula C11H17NO.ClH
Molecular Weight 215.72
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-AMINOPROPYL)-2,6-XYLENOL HYDROCHLORIDE

SMILES

Cl.CC(N)CC1=CC(C)=C(O)C(C)=C1

InChI

InChIKey=DRLZGRQTCWVOKV-UHFFFAOYSA-N
InChI=1S/C11H17NO.ClH/c1-7-4-10(6-9(3)12)5-8(2)11(7)13;/h4-5,9,13H,6,12H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula C11H17NO
Molecular Weight 179.2588
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 Mon Mar 31 23:23:18 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:18 GMT 2025
Record UNII
49L16OM5BV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(2-AMINOPROPYL)-2,6-XYLENOL HYDROCHLORIDE
Systematic Name English
2,6-XYLENOL, 4-(2-AMINOPROPYL)-, HYDROCHLORIDE
Preferred Name English
PHENOL, 4-(2-AMINOPROPYL)-2,6-DIMETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
PHENETHYLAMINE, 4-HYDROXY-ALPHA,3,5-TRIMETHYL-, HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
90674
Created by admin on Mon Mar 31 23:23:18 GMT 2025 , Edited by admin on Mon Mar 31 23:23:18 GMT 2025
PRIMARY
FDA UNII
49L16OM5BV
Created by admin on Mon Mar 31 23:23:18 GMT 2025 , Edited by admin on Mon Mar 31 23:23:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID80947848
Created by admin on Mon Mar 31 23:23:18 GMT 2025 , Edited by admin on Mon Mar 31 23:23:18 GMT 2025
PRIMARY
CAS
24973-31-7
Created by admin on Mon Mar 31 23:23:18 GMT 2025 , Edited by admin on Mon Mar 31 23:23:18 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE