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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8ClO.Na
Molecular Weight 226.634
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2-CHLORO-4-PHENYLPHENATE

SMILES

[Na+].[O-]C1=CC=C(C=C1Cl)C2=CC=CC=C2

InChI

InChIKey=ARCOPJIXLBWKLT-UHFFFAOYSA-M
InChI=1S/C12H9ClO.Na/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9;/h1-8,14H;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C12H8ClO
Molecular Weight 203.644
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Characterization of steroid hormone receptor activities in 100 hydroxylated polychlorinated biphenyls, including congeners identified in humans.
2011-11-18
Identification and characterization of two novel cytosolic sulfotransferases, SULT1 ST7 and SULT1 ST8, from zebrafish.
2008-08-29
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006-11
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:35:14 GMT 2025
Edited
by admin
on Mon Mar 31 21:35:14 GMT 2025
Record UNII
3HNV61OUA1
Record Status Validated (UNII)
Record Version
  • Download
Related Record Type
Name Type Language
SODIUM 2-CHLORO-4-PHENYLPHENATE
Preferred Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 62215
Created by admin on Mon Mar 31 21:35:14 GMT 2025 , Edited by admin on Mon Mar 31 21:35:14 GMT 2025
Code System Code Type Description
CAS
31366-97-9
Created by admin on Mon Mar 31 21:35:14 GMT 2025 , Edited by admin on Mon Mar 31 21:35:14 GMT 2025
PRIMARY
PUBCHEM
23705733
Created by admin on Mon Mar 31 21:35:14 GMT 2025 , Edited by admin on Mon Mar 31 21:35:14 GMT 2025
PRIMARY
FDA UNII
3HNV61OUA1
Created by admin on Mon Mar 31 21:35:14 GMT 2025 , Edited by admin on Mon Mar 31 21:35:14 GMT 2025
PRIMARY
Related Record Type Details
SUB_CONCEPT->SUBSTANCE