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Details

Stereochemistry ACHIRAL
Molecular Formula C14H19Cl2NO3
Molecular Weight 320.212
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[4-[Bis(2-chloroethyl)amino]phenoxy]-2-methylpropanoic acid

SMILES

CC(C)(OC1=CC=C(C=C1)N(CCCl)CCCl)C(O)=O

InChI

InChIKey=HOVXYVAXQNQKGL-UHFFFAOYSA-N
InChI=1S/C14H19Cl2NO3/c1-14(2,13(18)19)20-12-5-3-11(4-6-12)17(9-7-15)10-8-16/h3-6H,7-10H2,1-2H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C14H19Cl2NO3
Molecular Weight 320.212
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 15:48:29 GMT 2025
Edited
by admin
on Wed Apr 02 15:48:29 GMT 2025
Record UNII
7C9FT67WV4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Propanoic acid, 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methyl-
Preferred Name English
2-[4-[Bis(2-chloroethyl)amino]phenoxy]-2-methylpropanoic acid
Systematic Name English
Code System Code Type Description
CAS
47080-36-4
Created by admin on Wed Apr 02 15:48:29 GMT 2025 , Edited by admin on Wed Apr 02 15:48:29 GMT 2025
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FDA UNII
7C9FT67WV4
Created by admin on Wed Apr 02 15:48:29 GMT 2025 , Edited by admin on Wed Apr 02 15:48:29 GMT 2025
PRIMARY
PUBCHEM
282011
Created by admin on Wed Apr 02 15:48:29 GMT 2025 , Edited by admin on Wed Apr 02 15:48:29 GMT 2025
PRIMARY