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| CAS No.: | 58306-30-2 |
|---|---|
| Name: | Febantel |
| Article Data: | 3 |
| Molecular Structure: | |
|
|
|
| Formula: | C20H22N4O6S |
| Molecular Weight: | 446.484 |
| Synonyms: | Carbamicacid, [[2-[(methoxyacetyl)amino]-4-(phenylthio)phenyl]carbonimidoyl]bis-,dimethyl ester (9CI);Rintal; |
| EINECS: | 261-205-0 |
| Density: | 1.31 g/cm3 |
| Melting Point: | 129-130 °C |
| Boiling Point: | 215°C (rough estimate) |
| Solubility: | insoluble in water |
| Appearance: | white to off-white solid |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22 |
| PSA: | 152.65000 |
| LogP: | 3.84990 |
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Chemistry
Molecular Structure of 2-Methylcyclohexanone (CAS NO.58306-30-2):
IUPAC Name: methyl (NE)-N-[[2-[(2-methoxyacetyl)amino]-4-phenylsulfanylanilino]-(methoxycarbonylamino)methylidene]carbamate
Empirical Formula: C20H22N4O6S
Molecular Weight: 446.48
EINECS: 261-205-0
H bond acceptors: 10
H bond donors: 3
Freely Rotating Bonds: 9
Polar Surface Area: 126.28Å2
Index of Refraction: 1.598
Molar Refractivity: 115.81 cm3
Molar Volume: 339.3 cm3
Surface Tension: 48.9 dyne/cm
Density: 1.31 g/cm3
Melting point: 129-130°C
Product Categories: Intermediates & Fine Chemicals; Pharmaceuticals
InChI
InChI=1/C20H22N4O6S/c1-28-12-17(25)21-16-11-14(31-13-7-5-4-6-8-13)9-10-15(16)22-18(23-19(26)29-2)24-20(27)30-3/h4-11H,12H2,1-3H3,(H,21,25)(H2,22,23,24,26,27)
Smiles
c1(c(\N=C(\NC(OC)=O)NC(OC)=O)ccc(c1)Sc1ccccc1)NC(COC)=O
Toxicity Data With Reference
| 1. | orl-rat LD50:10,605 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 28 (1978),2193. | ||
| 2. | orl-rbt LD50:1250 mg/kg | ARZNAD Arzneimittel-Forschung. Drug Research. 28 (1978),2193. |
Safety Profile
Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NOx and SOx.
Safety information of Febantel (CAS NO.58306-30-2):
Hazard Codes: 
Xn
Risk Statements: 22
R22: Harmful if swallowed
RTECS: FB3955000
Specification
Febantel , with CAS number of 58306-30-2, can be called Carbamic acid, ((2-((methoxyacetyl)amino)-4-(phenylthio)phenyl)carbonimidoyl)bis-, dimethyl ester ; Dimethyl ((2-(2-methoxyacetamido)-4-(phenylthio)phenyl)imidocarbonyl)dicarbamate ; N-(2-(2,3-Bis-(methoxycarbonyl)-guanidino)-5-(phenylthio)-phenyl)-2-methoxyacetamide ; Rintal ; Oratel . Febantel (CAS NO.58306-30-2) is used as an anthelmintic.