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| CAS No.: | 6306-71-4 |
|---|---|
| Name: | Lobendazole |
| Article Data: | 21 |
| Molecular Structure: | |
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| Formula: | C10H11N3O2 |
| Molecular Weight: | 205.216 |
| Synonyms: | Lobendazole [USAN:INN];Carbamic acid,1H-benzimidazol-2-yl-,ethyl ester;Ethyl 2-benzimidazolylcarbamate;2-Carboethoxyaminobenzimidazole;SKF24529;Benzimidazol-2-ylcarbamate ethyl ester;N-(2-Benzimidazolyl)carbamic acid ethyl ester;EBC;Lobendazolum [INN-Latin];SKandF 24529;Carbamic acid, (2-benzimidazolyl)-, ethyl ester;2-((Ethoxycarbonyl)amino)benzimidazole;.DELTA.2,N-Benzimidazolinecarbamic acid, ethyl ester;ethyl N-(1H-benzoimidazol-2-yl)carbamate;10493-18-2;Carbamic acid, 1H-benzimidazol-2-yl-, ethyl ester;Lobendazole;Carbamic acid, 1H-benzimidazol-2-yl-,ethyl ester;SK&F 24529;Ethyl benzimidazolecarbamate;Benzimidazole carbamate dethyle [French];delta2,N-Benzimidazolinecarbamic acid, ethyl ester;Ethyl 2-benzimidazolecarbamate;N-(2-Benzimidazolyl)-urethane;Ethyl 1H-benzimidazol-2-ylcarbamate;SKF 24529;2-Benzimidazolecarbamic acid, ethyl ester;58318-57-3;2-[(Ethoxycarbonyl)amino]benzimidazole;Ethyl N-(2-benzimidazolyl)carbamate;2-Benzimidazolecarbamic acid, ethyl ester (8CI);Ethyl 1H-benzimidazolylcarbamate;Lobendazol [INN-Spanish];Lobendazole, 1H-benzimidazol-2-yl-, ethyl ester; |
| Density: | 1.358g/cm3 |
| PSA: | 67.01000 |
| LogP: | 2.20430 |
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Specification
The N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester with the cas number 6306-71-4. It is also called ethyl N-(1H-benzimidazol-2-yl)carbamate, which is also it's IUPAC name, and it's system Name are (1) 2-Benzimidazolecarbamic acid, ethyl ester (8CI) ; (2) Carbamic acid, (2-benzimidazolyl)-, ethyl ester ; (3) Carbamic acid, 1H-benzimidazol-2-yl-, ethyl ester.
Physical properties about N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester (1)ACD/LogP: 2.05 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): 1.47 ; (4)ACD/LogD (pH 7.4): 2.04 ; (5)ACD/BCF (pH 5.5): 5.61 ; (6)ACD/BCF (pH 7.4): 20.56 ; (7)ACD/KOC (pH 5.5): 81.77 ; (8)ACD/KOC (pH 7.4): 299.83 ; (9)#H bond acceptors: 5 ; (10)#H bond donors: 2 ; (11)#Freely Rotating Bonds: 2 ; (12)Polar Surface Area: 47.36 Å2 ; (13)Index of Refraction: 1.682 ; (14)Molar Refractivity: 57.26 cm3 ; (15)Molar Volume: 151 cm3 ; (16)Polarizability: 22.7× 10-24cm3 ; (17)Surface Tension: 64.4 dyne/cm ; (18)Density: 1.358 g/cm3
Uses of N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester : It is metabolite of thiophanate. And it is used as veterinary anthelmintic because of reproductive effect. 1H-benzoimidazol-2-ylamine can be obtained from N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester in dimethylformamide with heating for 4 hour(s), yield is 82 % .
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When you are using N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester, please be cautious about it as the following: N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester is quite irritating to eyes, respiratory system and skin. When you are using this chemical, please wear suitable gloves and eye/face protection to avoid contact with skin and eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, Do not breathe dust, because it is quite harmful by inhalation, in contact with skin and if swallowed.
You can still convert the following datas into molecular structure :
(1).Smiles: c12c(nc([nH]1)NC(OCC)=O)cccc2
(2).InChI=1/C10H11N3O2/c1-2-15-10(14)13-9-11-7-5-3-4-6-8(7)12-9/h3-6H,2H2,1H3,(H2,11,12,13,14)
Toxic information of N-(1H-Benzimidazol-2-yl)carbamic acid ethyl ester can be showed as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04389, |