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| CAS No.: | 38083-17-9 |
|---|---|
| Name: | Climbazole |
| Article Data: | 6 |
| Molecular Structure: | |
|
|
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| Formula: | C15H17ClN2O2 |
| Molecular Weight: | 292.765 |
| Synonyms: | 1-[(4-Chlorophenoxy)(tert-butylcarbonyl)methyl]imidazole;BAY-e 6975;Baypival;Crinipan AD; |
| EINECS: | 253-775-4 |
| Density: | 1.17 g/cm3 |
| Melting Point: | 96-100 °C |
| Boiling Point: | 447.5 °C at 760 mmHg |
| Flash Point: | 224.4 °C |
| Solubility: | 58mg/L at 25℃ |
| Appearance: | off-white to pale yellow crystalline powder |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22 |
| Safety: | 60-61 |
| Transport Information: | UN 3077 |
| PSA: | 44.12000 |
| LogP: | 3.72930 |
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Specification
1-(p-chlorophenoxy)-3,3-dimethyl-1-(1-imidazolyl)-2-butanone , with the CAS register number 38083-17-9, is also known to us as 1-(4-Chloro-phenoxy)-1-(2,5-dihydro-imidazole-1-yl)-3,3-dimethyl-butan-2-one ; 1-(4-chlorophenoxy)-1-(imidazol-1-yl)-3,3-dimethylbutanone ; 1-(p-chlorophenoxy)-3,3-dimethyl-1-(1-imidazolyl)-2-butanon;1-(p-chlorophenoxy)-3,3-dimethyl-1-(1-imidazolyl)-2-Butanone ; bay-e6975 ; baypival ; RadixAsteris ; 1-(4-clorophenoxy)-3,3-dimethyl-1-(imidazole-1-yl)-2-butanone .
Characteristics of this kind of chemical are as below: (1)ACD/BCF (pH 5.5): 69.79 ; (2)ACD/BCF (pH 7.4): 171.71 ; (3)ACD/KOC (pH 5.5): 559.65 ; (4)ACD/KOC (pH 7.4): 1377.02 ; (5)#H bond acceptors: 4; (6)5 Polar Surface Area: 44.12 ; (7)Index of Refraction: 1.56 ; (8)Molar Refractivity: 80.4 cm3 ; (9)Molar Volume: 248.4 cm3 ; (10)Polarizability: 31.87 ×10-24cm3 ; (11)Surface Tension: 39.7 dyne/cm ; (12)Density: 1.17 g/cm3 ; (13)Flash Point: 224.4 °C ; (14)Enthalpy of Vaporization: 70.59 kJ/mol ; (15)Boiling Point: 447.5 °C at 760 mmHg ; (16)Vapour Pressure: 3.34E-08 mmHg at 25°C.
It is a kind of off-white to pale yellow crystalline powder. Product categories of this chemical are pesticide;alpha sort;c;calphabetic;ci -clpesticides;conazoles;fungicides;pesticides&metabolites. As to its preparation products, it is methidathion and as to the raw material, they are imidazole , Pyrazole , and 3-Thiophenezoic acid . As for its usage, it is has the function of broad spectrum sterilization and mainly used for anti-itch shampoo and hair shampoo. It also can be used for anti-bacterial soap,shower gel,drug.toothpaste,mouth rinse fluid,etc.
Being a kind of harmful chemcial, it may cause damage to health and if swallowed, it will have serious damage to our health. So while using this kind of chemical, we need to be very careful and take the following instructions. Wear suitable goloves to protect ourselves and if any accident, seek for medical help immediately.
In addition, you could convert the following data information into the molecular structrue:
SMILES:Clc2ccc(OC(C(=O)C(C)(C)C)n1ccnc1)cc2
InChI:InChI=1/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3
InChIKey:OWEGWHBOCFMBLP-UHFFFAOYAP
As for its market information, you could find many supplier in China, such as Yongyi Chemicals Group Co., Ltd.
Below is the toxicity information of 1-(p-chlorophenoxy)-3,3-dimethyl-1-(1-imidazolyl)-2-butanone:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | oral | 400mg/kg (400mg/kg) | "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 832, 1986. | |
| rat | LD50 | skin | > 5gm/kg (5000mg/kg) | Farmaco. Vol. 53, Pg. 405, 1998. |