Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C9H7NO.H2O4S |
Molecular Weight | 388.394 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.OC1=C2N=CC=CC2=CC=C1.OC3=C4N=CC=CC4=CC=C3
InChI
InChIKey=YYVFXSYQSOZCOQ-UHFFFAOYSA-N
InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)
Molecular Formula | H2O4S |
Molecular Weight | 98.078 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C9H7NO |
Molecular Weight | 145.158 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
DescriptionCurator's Comment: description was created based on several sources, including:
http://www.cosmeticsinfo.org/ingredient/benzoxiquine-0
Curator's Comment: description was created based on several sources, including:
http://www.cosmeticsinfo.org/ingredient/benzoxiquine-0
In cosmetics and personal care products, Benzoxiquine has been reported to be used in the formulation of hair tonics, dressings, and other hair grooming aids. Benzoxiquine is described as a biocide for use in cosmetic products. It is currently reported to be used in only one product. In a separate finding, the Food and Drug Administration determined that Benzoxiquine is not generally recognized as safe and effective in over-the-counter topical antifungal drug products. The only data available on the toxicity of Benzoxiquine indicates that it is mutagenic in the Ames test without metabolic activation. Because of the lack of data, the safety of Benzoxiquine could not be substantiated. The data needed to make a safety assessment include purity/impurities, ultraviolet absorption (if there is absorption, then photosensitization data will be needed), 28-day dermal toxicity, dermal teratogenicity, ocular irritation (if already available only), dermal irritation and sensitization, and two different genotoxicity studies (one using a mammalian system). If the latter data are positive, dermal carcinogenesis data using the methods of the National Toxicology Program will be needed. It cannot be concluded that Benzoxiquine is safe for use in cosmetic products until these safety data have been obtained and evaluated.
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:17:18 GMT 2023
by
admin
on
Fri Dec 15 15:17:18 GMT 2023
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Record UNII |
61VUG75Y3P
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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EPA PESTICIDE CODE |
59804
Created by
admin on Fri Dec 15 15:17:18 GMT 2023 , Edited by admin on Fri Dec 15 15:17:18 GMT 2023
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NCI_THESAURUS |
C28394
Created by
admin on Fri Dec 15 15:17:18 GMT 2023 , Edited by admin on Fri Dec 15 15:17:18 GMT 2023
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Code System | Code | Type | Description | ||
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m6151
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PRIMARY | Merck Index | ||
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DBSALT002678
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PRIMARY | |||
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8-hydroxyquinoline sulfate
Created by
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61VUG75Y3P
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CHEMBL310555
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PRIMARY | |||
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61VUG75Y3P
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PRIMARY | |||
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100000088419
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C80848
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8639
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134-31-6
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205-137-1
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42836
Created by
admin on Fri Dec 15 15:17:18 GMT 2023 , Edited by admin on Fri Dec 15 15:17:18 GMT 2023
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PRIMARY | RxNorm | ||
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SUB14151MIG
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DTXSID6025436
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1490103
Created by
admin on Fri Dec 15 15:17:18 GMT 2023 , Edited by admin on Fri Dec 15 15:17:18 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |