A3310212
Denatonium Benzoate , 98% , 3734-33-6
Synonym(s):
N,N-Diethyl-N-[(2,6-dimethylphenyl-carbamoyl)-methyl]-benzyl-ammonium benzoate;Benzyldiethyl(2,6-xylyl-carbamoyl-methyl)-ammonium benzoate;THS 839
CAS NO.：3734-33-6
Empirical Formula: C28H34N2O3
Molecular Weight: 446.58
MDL number: MFCD00031578
EINECS: 223-095-2
| Pack Size | Price | Stock | Quantity |
| 1G | RMB23.20 | In Stock |
|
| 5G | RMB37.60 | In Stock |
|
| 25G | RMB115.20 | In Stock |
|
| 100g | RMB285.60 | In Stock |
|
| 500g | RMB1000.00 | In Stock |
|
| others | Enquire |
Update time: 2022-07-08
PRODUCT Properties
| Melting point: | 164-168 °C (lit.) |
| Boiling point: | 555.91°C (rough estimate) |
| Density | 1.1256 (rough estimate) |
| vapor pressure | 0Pa at 25℃ |
| refractive index | 1.5800 (estimate) |
| Flash point: | 100℃ |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | methanol: 50 mg/mL, clear, colorless |
| form | Solid |
| color | White to Off-White |
| Odor | at 100.00?%. bland |
| Water Solubility | 42.555g/L at 25℃ |
| Merck | 14,2891 |
| BRN | 8179408 |
| Stability: | Stable. Incompatible with strong oxidizing agents. |
| Cosmetics Ingredients Functions | FRAGRANCE DENATURANT |
| Cosmetic Ingredient Review (CIR) | Denatonium Benzoate (3734-33-6) |
| InChI | 1S/C21H28N2O.C7H6O2/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;8-7(9)6-4-2-1-3-5-6/h7-14H,5-6,15-16H2,1-4H3;1-5H,(H,8,9) |
| InChIKey | VWTINHYPRWEBQY-UHFFFAOYSA-N |
| SMILES | [O-]C(=O)c1ccccc1.CC[N+](CC)(CC(=O)Nc2c(C)cccc2C)Cc3ccccc3 |
| LogP | 2.2 at 25℃ |
| CAS DataBase Reference | 3734-33-6(CAS DataBase Reference) |
| EPA Substance Registry System | Denatonium benzoate (3734-33-6) |
Description and Uses
The bitterest compound knownDenatonium benzoate is used as an alcohol denaturant and flavor in pharmaceuticals. It is also used in antifreeze, nail biting preventions, respirator mask fit-testing, animal repellents, liquid soaps and shampoos. Further, it is used in air care products. It acts as H1 antihistamine. In addition to this, it is used as a disinfectant.
Safety
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302-H412 |
| Precautionary statements | P264-P270-P273-P301+P312-P501 |
| PPE | dust mask type N95 (US), Eyeshields, Gloves |
| Hazard Codes | Xn,Xi |
| Risk Statements | 22-36/37/38-20/21/22 |
| Safety Statements | 26-36-37/39 |
| WGK Germany | 2 |
| RTECS | BO6650000 |
| TSCA | TSCA listed |
| HS Code | 29242995 |
| Storage Class | 6.1A - Combustible acute toxic Cat. 1 and 2 very toxic hazardous materials |
| Hazard Classifications | Acute Tox. 2 Inhalation Acute Tox. 4 Oral Eye Dam. 1 |
