Introduction：Basic information about CAS 1674-99-3|Denatonium chloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Denatonium chloride |
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| CAS Number | 1674-99-3 | Molecular Weight | 360.92100 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C21H29ClN2O | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium,chloride |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C21H29ClN2O |
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| Molecular Weight | 360.92100 |
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| Exact Mass | 360.19700 |
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| PSA | 29.10000 |
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| LogP | 1.37570 |
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| InChIKey | YNQALPDYZRNHNK-UHFFFAOYSA-N |
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| SMILES | CC[N+](CC)(CC(=O)Nc1c(C)cccc1C)Cc1ccccc1.[Cl-] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- BO6660000
- CHEMICAL NAME :
- Ammonium, benzyldiethyl((2,6-xylylcarbamoyl)methyl)-, chloride
- CAS REGISTRY NUMBER :
- 1674-99-3
- LAST UPDATED :
- 198806
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C21-H29-N2-O.Cl
- MOLECULAR WEIGHT :
- 360.97
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 25 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- APSXAS Acta Pharmaceutica Suecica. (Apotekarsocieteten-Farmacevtiska Foereningen, Box 1136, S-111, 81 Stockholm, Sweden) V.1- 1964- Volume(issue)/page/year: 2,213,1965
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Synonyms
| AmbscPOD_05/0837 |
| Benzyldiethyl((2,6-xylylcarbamoyl)methyl)ammonium chloride |
| Denatonium Chloride |
| N-{2-[(2,6-dimethylphenyl)-amino]-2-oxoethyl}-N,N-diethyl-benzenemethanaminium chloride |
| Ammonium,benzyldiethyl((2,6-xylylcarbamoyl)methyl)-,chloride |
| benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium chloride |
| Benzenemethanaminium,N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-,chloride |
