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Details

Stereochemistry ACHIRAL
Molecular Formula C12H15IO2
Molecular Weight 318.1508
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(4-Ethyl-3-iodophenyl)-2-methylpropanoic acid

SMILES

CCC1=CC=C(C=C1I)C(C)(C)C(O)=O

InChI

InChIKey=RUVGXZCQYVEAKQ-UHFFFAOYSA-N
InChI=1S/C12H15IO2/c1-4-8-5-6-9(7-10(8)13)12(2,3)11(14)15/h5-7H,4H2,1-3H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula C12H15IO2
Molecular Weight 318.1508
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 19:35:27 GMT 2025
Edited
by admin
on Wed Apr 02 19:35:27 GMT 2025
Record UNII
AWK669JXF6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Ethyl-3-iodo-?,?-dimethylbenzeneacetic acid
Preferred Name English
2-(4-Ethyl-3-iodophenyl)-2-methylpropanoic acid
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID601252711
Created by admin on Wed Apr 02 19:35:27 GMT 2025 , Edited by admin on Wed Apr 02 19:35:27 GMT 2025
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FDA UNII
AWK669JXF6
Created by admin on Wed Apr 02 19:35:27 GMT 2025 , Edited by admin on Wed Apr 02 19:35:27 GMT 2025
PRIMARY
CAS
1256584-73-2
Created by admin on Wed Apr 02 19:35:27 GMT 2025 , Edited by admin on Wed Apr 02 19:35:27 GMT 2025
PRIMARY
PUBCHEM
66834609
Created by admin on Wed Apr 02 19:35:27 GMT 2025 , Edited by admin on Wed Apr 02 19:35:27 GMT 2025
PRIMARY