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| CAS No.: | 25875-50-7 |
|---|---|
| Name: | Robenidine hydrochloride |
| Molecular Structure: | |
|
|
|
| Formula: | C15H14Cl3N5 |
| Molecular Weight: | 370.669 |
| Synonyms: | Carbonimidicdihydrazide, bis[(4-chlorophenyl)methylene]-, monohydrochloride (9CI);Guanidine, 1,3-bis[(p-chlorobenzylidene)amino]-, monohydrochloride (8CI);1,3-Bis[(p-chlorobenzylidene)amino]guanidine monohydrochloride;Cycostat;Robenzidene; |
| EINECS: | 247-307-8 |
| Melting Point: | 252-254 °C |
| Boiling Point: | 475.8 °C at 760 mmHg |
| Flash Point: | 241.6 °C |
| Appearance: | off-white solid |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 22 |
| PSA: | 72.63000 |
| LogP: | 5.15890 |
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1,3-diaminoguanidine hydrochloride
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4-chlorobenzaldehyde
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride In methanol at 50℃; for 1h; pH=1.5; pH-value; Temperature; | 98.82% |
| In ethanol for 16h; Reflux; |
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
- 71189-15-6
2-(isocyanatomethyl)furan
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 84% |
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
- 3173-56-6
benzyl isothiocyanate
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 61% |
- 541-41-3
chloroformic acid ethyl ester
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 42% |
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
- 543-27-1
isobutyl chloroformate
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 39% |
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
- 109-90-0
ethyl isocyanate
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 33% |
- 2525-62-4
Hexyl isocyanate
- 25875-50-7
2,2′-bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide monohydrochloride
| Conditions | Yield |
|---|---|
| With N-ethyl-N,N-diisopropylamine In acetonitrile for 2.5h; Reflux; | 16% |
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Chemistry
Molecular Structure of Robenidine HCl (CAS NO.25875-50-7):
.gif)
IUPAC Name: 1,2-bis[(E)-(4-chlorophenyl)methylideneamino]guanidine hydrochloride
Empirical Formula: C15H14Cl3N5
Molecular Weight: 370.6642
H bond acceptors: 5
H bond donors: 3
Freely Rotating Bonds: 4
Polar Surface Area: 72.63 Å2
Flash Point: 241.6 °C
Enthalpy of Vaporization: 75.35 kJ/mol
Boiling Point: 475.8 °C at 760 mmHg
Vapour Pressure: 1.9E-09 mmHg at 25°C
EINECS: 247-307-8
Melting point: 252-254°C
Storage temp: 0-6°C
Product Categories: Intermediates & Fine Chemicals; Pharmaceuticals
InChI
InChI=1/C15H13Cl2N5.ClH/c16-13-5-1-11(2-6-13)9-19-21-15(18)22-20-10-12-3-7-14(17)8-4-12;/h1-10H,(H3,18,21,22);1H/b19-9+,20-10+;
Smiles
c1(ccc(Cl)cc1)\C=N\NC(N\N=C\c1ccc(Cl)cc1)=[NH+].[ClH-]
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | 390mg/kg (390mg/kg) | Journal of Agricultural and Food Chemistry. Vol. 23, Pg. 724, 1975. | |
| rat | LD50 | oral | 390mg/kg (390mg/kg) | Journal of Agricultural and Food Chemistry. Vol. 21, Pg. 794, 1973. |
Safety Profile
Hazard Codes: 
Xn
Risk Statements: 22
R22:Harmful if swallowed.
RTECS: ME8651000
Specification
Robenidine HCl , with CAS number of 25875-50-7, can be called Carbonimidicdihydrazide, bis[(4-chlorophenyl)methylene]-, monohydrochloride (9CI) ; Guanidine, 1,3-bis[(p-chlorobenzylidene)amino]-, monohydrochloride (8CI) ; 1,3-Bis[(p-chlorobenzylidene)amino]guanidine monohydrochloride ; Cycostat ; Robenidine hydrochloride ; Robenzidene . It is an off-White Solid, can be used as a coccidiostat.