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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClO3
Molecular Weight 186.592
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CHLOROPHENOXYACETIC ACID

SMILES

OC(=O)COC1=CC=C(Cl)C=C1

InChI

InChIKey=SODPIMGUZLOIPE-UHFFFAOYSA-N
InChI=1S/C8H7ClO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H7ClO3
Molecular Weight 186.592
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 Fri Dec 15 15:04:27 GMT 2023
Edited
by admin
on Fri Dec 15 15:04:27 GMT 2023
Record UNII
4EMM3U5P3K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CHLOROPHENOXYACETIC ACID
HSDB  
Systematic Name English
(P-CHLOROPHENOXY)ACETIC ACID
Common Name English
CH-100 FREE ACID
Common Name English
TOMATOTONE
Brand Name English
PARACHLOROPHENOXYACETIC ACID
Systematic Name English
NSC-8769
Code English
TOMATONE
Brand Name English
P-CHLOROPHENOXYACETIC ACID
Common Name English
4-CHLOROPHENOXYACETIC ACID [HSDB]
Common Name English
(4-CHLOROPHENOXY)ACETIC ACID
Systematic Name English
NSC-9213
Code English
Classification Tree Code System Code
EPA PESTICIDE CODE 19401
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
Code System Code Type Description
NSC
9213
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
MESH
C007017
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
CHEBI
1808
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
CAS
122-88-3
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
WIKIPEDIA
4-CHLOROPHENOXYACETIC ACID
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
FDA UNII
4EMM3U5P3K
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
PUBCHEM
26229
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID9034282
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
ECHA (EC/EINECS)
204-581-3
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
HSDB
3944
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
NSC
8769
Created by admin on Fri Dec 15 15:04:27 GMT 2023 , Edited by admin on Fri Dec 15 15:04:27 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT