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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H6Cl4O2.2Na
Molecular Weight 381.977
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DISODIUM 2,2'-METHYLENEBIS(4,6-DICHLOROPHENOXIDE)

SMILES

[Na+].[Na+].[O-]C1=C(Cl)C=C(Cl)C=C1CC2=C([O-])C(Cl)=CC(Cl)=C2

InChI

InChIKey=HWMSTPYCOZSCRP-UHFFFAOYSA-L
InChI=1S/C13H8Cl4O2.2Na/c14-8-2-6(12(18)10(16)4-8)1-7-3-9(15)5-11(17)13(7)19;;/h2-5,18-19H,1H2;;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula C13H6Cl4O2
Molecular Weight 335.998
Charge -2
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
Synthesis and antimicrobial activities of halogenated bis(hydroxyphenyl)methanes.
2009-02-01
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:45:19 GMT 2025
Edited
by admin
on Mon Mar 31 21:45:19 GMT 2025
Record UNII
VR13H0A0TA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DISODIUM 2,2'-METHYLENEBIS(4,6-DICHLOROPHENOXIDE)
Systematic Name English
2,2'-METHYLENEBIS(4,6-DICHLOROPHENOL) DISODIUM SALT
Preferred Name English
PHENOL, 2,2'-METHYLENEBIS(4,6-DICHLORO-, SODIUM SALT (1:2)
Systematic Name English
PHENOL, 2,2'-METHYLENEBIS(4,6-DICHLORO-, DISODIUM SALT
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 55006
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID9041314
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
PRIMARY
PUBCHEM
111919
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
PRIMARY
ECHA (EC/EINECS)
273-362-2
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
PRIMARY
CAS
68957-70-0
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
PRIMARY
FDA UNII
VR13H0A0TA
Created by admin on Mon Mar 31 21:45:19 GMT 2025 , Edited by admin on Mon Mar 31 21:45:19 GMT 2025
PRIMARY