DICHLOROPHEN DISODIUM

US Previously Marketed

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H8Cl2O2.2Na
Molecular Weight	313.087
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=IDPAELWVMULBFJ-UHFFFAOYSA-L

InChI=1S/C13H10Cl2O2.2Na/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17;;/h1-4,6-7,16-17H,5H2;;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C13H8Cl2O2
Molecular Weight	267.107
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: http://www.ncbi.nlm.nih.gov/pubmed/9168328
Curator's Comment: Description was created based on several sources, including http://www.ncbi.nlm.nih.gov/pubmed/15162836 and http://datasheets.scbt.com/sc-255083.pdf

Dichlorophene is a halogenated phenolic compound that functions as a bacteriocide and fungicide in cosmetics. Dichlorophene was reported to be used in a total of five cosmetic formulations at concentrations of 0% to 1.0%. Dichlorophen is used in the treatment of tapeworm infestation in man and animals and is the basis of a preparation against athlete’s foot. As a fungicide and bactericide it is recommended for the protection of textiles and materials including horticultural benches and equipment against moulds and algae.

CNS Activity

Originator

Approval Year

Targets

Primary Target	Pharmacology	Potency
Indoleamine 2,3-dioxygenase 19 Target ID: CHEMBL4685 Sources: http://www.ncbi.nlm.nih.gov/pubmed/20055453	Inhibitor 8297	70.0 µM [IC50]
G. lamblia growth 3 Target ID: G. lamblia growth Sources: http://www.ncbi.nlm.nih.gov/pubmed/3872626	Inhibitor 8297
T. vaginalis growth 3 Target ID: T. vaginalis growth Sources: http://www.ncbi.nlm.nih.gov/pubmed/3872626	Inhibitor 8297
2-propanol-supported respiration of Entamoeba histolytica 3 Target ID: 2-propanol-supported respiration of Entamoeba histolytica Sources: http://www.ncbi.nlm.nih.gov/pubmed/6086381	Inhibitor 8297

Conditions

Condition	Modality	Highest Phase	Product
Fasciolopsiasis 3 Sources: http://www.ncbi.nlm.nih.gov/pubmed/7381983	Curative	Basic research	Unknown Approved Use Unknown
Giardiasis 12 Sources: http://www.ncbi.nlm.nih.gov/pubmed/3872626	Curative	Basic research	Unknown Approved Use Unknown
Trichomoniasis 18 Sources: http://www.ncbi.nlm.nih.gov/pubmed/3872626	Curative	Basic research	Unknown Approved Use Unknown
Amoebiasis 11 Sources: http://www.ncbi.nlm.nih.gov/pubmed/6086381	Curative	Basic research	Unknown Approved Use Unknown
Athlete’s foot 7 Sources: http://www.mycota.co.uk/resources/downloads/Mycota%20Spray.pdf	Curative	Approved 8429	Mycota spray Approved Use For the treatment and prevention of athletes foot. Launch Date 2002

Doses

Dose	Population	Adverse events
1 % 1 times / day single, topical Studied dose Dose: 1 %, 1 times / day Route: topical Route: single Dose: 1 %, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/18714544/	unhealthy, 29 years n = 1 Health Status: unhealthy Condition: itching lesions Age Group: 29 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/18714544/	Other AEs: Contact dermatitis... Other AEs: Contact dermatitis Sources: https://pubmed.ncbi.nlm.nih.gov/18714544/
360 g 1 times / day single, oral Studied dose Dose: 360 g, 1 times / day Route: oral Route: single Dose: 360 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/9168328/	healthy, 59 years n = 1 Health Status: healthy Age Group: 59 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/9168328/	Other AEs: Death... Other AEs: Death Sources: https://pubmed.ncbi.nlm.nih.gov/9168328/
72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	Other AEs: Epigastric pain, Nausea... Other AEs: Epigastric pain Nausea Diarrhea Disturbance of liver function tests Injury to kidney Rhabdomyolysis Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/

AEs

AE	Dose	Population
Contact dermatitis	1 % 1 times / day single, topical Studied dose Dose: 1 %, 1 times / day Route: topical Route: single Dose: 1 %, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/18714544/	unhealthy, 29 years n = 1 Health Status: unhealthy Condition: itching lesions Age Group: 29 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/18714544/
Death	360 g 1 times / day single, oral Studied dose Dose: 360 g, 1 times / day Route: oral Route: single Dose: 360 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/9168328/	healthy, 59 years n = 1 Health Status: healthy Age Group: 59 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/9168328/
Diarrhea	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/
Disturbance of liver function tests	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/
Epigastric pain	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/
Injury to kidney	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/
Nausea	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/
Rhabdomyolysis	72 g 1 times / day single, oral Studied dose Dose: 72 g, 1 times / day Route: oral Route: single Dose: 72 g, 1 times / day Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/	unhealthy, 74 years n = 1 Health Status: unhealthy Condition: depression, chronic alcoholism, cardiac insufficiency and breast cancer Age Group: 74 years Sex: F Population Size: 1 Sources: https://pubmed.ncbi.nlm.nih.gov/23473463/

Sourcing

Vendor/Aggregator	ID	URL
001 Chemical	DY583178	https://www.001chemical.com/chem/97-23-4
3B Scientific (Wuhan) Corp	3B3-032688	http://www.3bsc.com/index/pro_info.php?id=53952
AA Blocks	AA00IMFM	https://www.aablocks.com/goods/Goods/detail?id=AA00IMFM
AHH Chemical co.,ltd	MT-30982	http://www.ahhchemical.com/product/MT-30982.html
AK Scientific, Inc. (AKSCI)	71230	http://www.aksci.com/item_detail.php?cat=71230
Aaron Chemicals	AR00IN7E	http://www.aaronchem.com/97-23-4
Acadechem	ACDS-033118	http://www.acadechemical.com/product/107817
Alfa Aesar	A12640	https://www.alfa.com/en/catalog/A12640/
Alfa Chemistry	ACM97234	https://materials.alfachemic.com/product/2-2-methylenebis-4-chlorophenol-cas-97-23-4-337163.html
Angene	AGN-PC-0JK6F8	http://www.angenechemical.com/productshow/AGN-PC-0JK6F8.html
Aurora Fine Chemicals LLC	K02.118.416	http://online.aurorafinechemicals.com/info?ID=K02.118.416
Avantor Inc	101187-650	https://us.vwr.com/store/catalog/product.jsp?catalog_number=101187-650
BioSynth	W-100114	https://www.biosynth.com/en/products/chemical-intermediates/advanced-intermediates/products/W-100114.html
Chem Scene	CS-3867	http://www.chemscene.com/97-23-4.html
ChemMol	30100307	http://www.chemmol.com/chemmol/30100307.html
ChemMol	49426336	http://www.chemmol.com/chemmol/49426336.html
Chemspace	CSSB00016994760	https://chem-space.com/CSSB00016994760
Finetech	FT-0739351	http://www.finetechnology-ind.com/prod/detail/pub/1322-43-6.html
Finetech	FT-0609137	http://www.finetechnology-ind.com/prod/detail/pub/97-23-4.html
FondChemical	FDB-2823	http://www.fondchemical.com/cpshow_cid_8_pid_2110.html
Glentham Life Sciences	GA7442	http://www.glentham.com/products/product/GA7442/
Hairui	HR132301	http://www.hairuichem.com/en/product/97-23-4.html
LGC Standards	DRE-C12440000	https://www.lgcstandards.com/US/en/p/DRE-C12440000
MedChem Express	HY-12638	https://www.medchemexpress.com/Dichlorophen.html
Molcore	MC583178	https://www.molcore.com/product/97-23-4
MuseChem	I005711	https://www.musechem.com/product/I005711.html
Parchem	Dichlorophene	http://www.parchem.com/chemical-supplier-distributor/Dichlorophene-030289.aspx
Parchem	30289	https://www.parchem.com/chemical-supplier-distributor/Dichlorophene-030289.aspx
Sigma-Aldrich	133221_ALDRICH	https://www.sigmaaldrich.com/catalog/product/aldrich/133221?utm_source=pubchem&utm_campaign=pubchem_2017&utm_medium=referral
Sigma-Aldrich	373982_ALDRICH	https://www.sigmaaldrich.com/catalog/product/aldrich/373982?utm_source=pubchem&utm_campaign=pubchem_2017&utm_medium=referral
Sigma-Aldrich	35992_SIAL	https://www.sigmaaldrich.com/catalog/product/sial/35992?utm_source=pubchem&utm_campaign=pubchem_2017&utm_medium=referral
Sinfoo Biotech	S017461	http://www.sinfoobiotech.com/product/1020859
Smolecule	S525957	http://www.smolecule.com/products/s525957
TCI (Tokyo Chemical Industry)	M0213	http://www.tcichemicals.com/eshop/en/us/commodity/M0213/index.html
THE BioTek	bt-267719	https://www.thebiotek.com/product/inhibitors/bt-267719
abcr GmbH	AB117899	http://www.abcr.com/shop/en/AB117899
eNovation Chemicals	D680496	https://www.enovationchem.com/ProductDetails.asp?ProductID=D680496
eNovation Chemicals	Y1054510	https://www.enovationchem.com/ProductDetails.asp?ProductID=Y1054510
iChemical	EBD13780	http://www.ichemical.com/products/97-23-4.html?utm_source=PubChem&utm_medium=website&utm_campaign=product%20catalogs
mcule	MCULE-2962145672	https://mcule.com/MCULE-2962145672/

PubMed

Title	Date	PubMed
[Allergy to preservatives].	1982	6221686
Safety assessment of dichlorophene and chlorophene.	2004	15162836
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524
Late patch test reaction to dichlorophene.	2008	18714544
Activity profiles of 309 ToxCast™ chemicals evaluated across 292 biochemical targets.	2011 Mar 28	21251949

Patents

Sample Use Guides

In Vivo Use Guide

A dose of 5 g is given usually in the morning to treat cestode infections

Route of Administration: Oral

In Vitro Use Guide

0.93 mM dichlorophene killed T. vaginalis within 24 hours in Asami media, Trophozoites of G. lamblia and T. vaginalis were killed in shorter than 10 min with 0.074 mM dichlorophene in serum-free media.

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:24:12 GMT 2023` Edited by `admin` on `Sat Dec 16 08:24:12 GMT 2023`
Record UNII	6Y5TLW5O7J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DICHLOROPHEN DISODIUM

Common Name

English

2,2'-DIHYDROXY-5,5'-DICHLORODIPHENYLMETHANE SODIUM SALT

Common Name

English

PHENOL, 2,2'-METHYLENEBIS(4-CHLORO-, DISODIUM SALT

Systematic Name

English

DISODIUM 2,2'-METHYLENEBIS(4-CHLOROPHENATE)

Systematic Name

English

PALACEL 30

Brand Name

English

PANACIDE M

Brand Name

English

DICHLOROPHEN DISODIUM SALT

Common Name

English

KENDOCIDE

Brand Name

English

J116.809F

Code

English

PHENOL, 2,2'-METHYLENEBIS(4-CHLORO-, SODIUM SALT (1:2)

Systematic Name

English

SODIUM, (METHYLENEBIS((4-CHLORO-O-PHENYLENE)OXY))DI-

Systematic Name

English

DISODIUM 2,2'-METHANEDIYLBIS(4-CHLOROPHENOLATE)

Systematic Name

English

DISODIUM 2,2'-METHYLENEBIS(4-CHLOROPHENOLATE)

Systematic Name

English

2,2'-METHYLENEBIS(4-CHLOROPHENOL), DISODIUM SALT

Systematic Name

English

EPA PESTICIDE CHEMICAL CODE 055003

Code

English

DISODIUM 2,2'-METHYLENEBIS(4-CHLOROPHENOXIDE)

Systematic Name

English

DISODIUM 4-CHLORO-2-((5-CHLORO-2-OXIDOPHENYL)METHYL)PHENOLATE

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

55005