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Details

Stereochemistry RACEMIC
Molecular Formula C11H16O3
Molecular Weight 196.2429
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(3,5-Dimethylphenoxy)-1,2-propanediol

SMILES

CC1=CC(OCC(O)CO)=CC(C)=C1

InChI

InChIKey=BUPIGXJCEVUNSJ-UHFFFAOYSA-N
InChI=1S/C11H16O3/c1-8-3-9(2)5-11(4-8)14-7-10(13)6-12/h3-5,10,12-13H,6-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C11H16O3
Molecular Weight 196.2429
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 Sat Dec 16 20:21:34 GMT 2023
Edited
by admin
on Sat Dec 16 20:21:34 GMT 2023
Record UNII
NYL8JJ28ZP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(3,5-Dimethylphenoxy)-1,2-propanediol
Systematic Name English
1,2-Propanediol, 3-(3,5-dimethylphenoxy)-
Systematic Name English
Rac-3-(3,5-Dimethylphenoxy)propane-1,2-diol
Common Name English
NSC-25239
Code English
Code System Code Type Description
CAS
59365-66-1
Created by admin on Sat Dec 16 20:21:34 GMT 2023 , Edited by admin on Sat Dec 16 20:21:34 GMT 2023
PRIMARY
NSC
25239
Created by admin on Sat Dec 16 20:21:34 GMT 2023 , Edited by admin on Sat Dec 16 20:21:34 GMT 2023
PRIMARY
FDA UNII
NYL8JJ28ZP
Created by admin on Sat Dec 16 20:21:34 GMT 2023 , Edited by admin on Sat Dec 16 20:21:34 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE