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

Details

Stereochemistry RACEMIC
Molecular Formula C11H17NO2
Molecular Weight 195.2582
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-AMINOPROPOXY)-3,5-DIMETHYLPHENOL

SMILES

CC(N)COC1=C(C)C=C(O)C=C1C

InChI

InChIKey=YWOSWRCXWBDSRQ-UHFFFAOYSA-N
InChI=1S/C11H17NO2/c1-7-4-10(13)5-8(2)11(7)14-6-9(3)12/h4-5,9,13H,6,12H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H17NO2
Molecular Weight 195.2582
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 Wed Apr 02 06:48:29 GMT 2025
Edited
by admin
on Wed Apr 02 06:48:29 GMT 2025
Record UNII
D9M8AQ3NDJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-HYDROXYMEXILETINE
Preferred Name English
4-(2-AMINOPROPOXY)-3,5-DIMETHYLPHENOL
Systematic Name English
PHENOL, 4-(2-AMINOPROPOXY)-3,5-DIMETHYL-
Systematic Name English
KO 2127
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID60968334
Created by admin on Wed Apr 02 06:48:29 GMT 2025 , Edited by admin on Wed Apr 02 06:48:29 GMT 2025
PRIMARY
CAS
53566-99-7
Created by admin on Wed Apr 02 06:48:29 GMT 2025 , Edited by admin on Wed Apr 02 06:48:29 GMT 2025
PRIMARY
FDA UNII
D9M8AQ3NDJ
Created by admin on Wed Apr 02 06:48:29 GMT 2025 , Edited by admin on Wed Apr 02 06:48:29 GMT 2025
PRIMARY
PUBCHEM
93286
Created by admin on Wed Apr 02 06:48:29 GMT 2025 , Edited by admin on Wed Apr 02 06:48:29 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE