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| Name |
Probonal |
EINECS | N/A |
| CAS No. | 28610-84-6 | Density | g/cm3 |
| PSA | 126.99000 | LogP | 0.92060 |
| Solubility | N/A | Melting Point |
165-166° |
| Formula | C13H19N2O3•CH3O4S | Boiling Point | °Cat760mmHg |
| Molecular Weight | 362.404 | Flash Point | °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intravenous route. Moderately toxic by ingestion, intraperitoneal, and subcutaneous routes. When heated to decomposition it emits toxic fumes of NOx and SOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
rimazolium metilsulfate;Rimazolium |
Probonal Chemical Properties
Product Name: Probonal (CAS NO.28610-84-6)
Molecular Formula: C13H19N2O3.CH3O4S
Molecular Weight: 362.44g/mol
Mol File: 28610-84-6.mol
Einecs: 249-103-4
H-Bond Donor: 0
H-Bond Acceptor: 7
Structure Descriptors of Probonal (CAS NO.28610-84-6):
IUPAC Name: ethyl1,6-dimethyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-1-ium-3-carboxylate; methyl sulfate
Canonical SMILES: CCOC(=O)C1=C[N+](=C2CCCC(N2C1=O)C)C.COS(=O)(=O)[O-]
InChI: InChI=1S/C13H19N2O3.CH4O4S/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16;1-5-6(2,3)4/h8-9H,4-7H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey: SEISMQVOJUJKGE-UHFFFAOYSA-M
Probonal Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| cat | LD50 | intravenous | 150mg/kg (150mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| dog | LD50 | intravenous | 230mg/kg (230mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| dog | LD50 | oral | 500mg/kg (500mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| guinea pig | LD50 | intraperitoneal | 500mg/kg (500mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| guinea pig | LD50 | subcutaneous | 420mg/kg (420mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| monkey | LD50 | oral | > 1200mg/kg (1200mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| monkey | LD50 | subcutaneous | > 900mg/kg (900mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| mouse | LD50 | intravenous | 200mg/kg (200mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| mouse | LD50 | oral | 1100mg/kg (1100mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| mouse | LD50 | subcutaneous | 500mg/kg (500mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| rabbit | LD50 | intravenous | 200mg/kg (200mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| rat | LD50 | intraperitoneal | 720mg/kg (720mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| rat | LD50 | intravenous | 217mg/kg (217mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 717, 1971. | |
| rat | LD50 | oral | 1500mg/kg (1500mg/kg) | BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 719, 1971. |
| rat | LD50 | subcutaneous | 750mg/kg (750mg/kg) | Arzneimittel-Forschung. Drug Research. Vol. 21, Pg. 727, 1971. |
Probonal Safety Profile
Poison by intravenous route. Moderately toxic by ingestion, intraperitoneal, and subcutaneous routes. When heated to decomposition it emits toxic fumes of NOx and SOx.
Probonal Specification
Probonal ,its CAS NO. is 28610-84-6,the synonyms is 4H-Pyrido(1,2-a)pyrimidinium, 6,7,8,9-tetrahydro-3-carboxy-1,6-dimethyl-4-oxo-, ethyl ester, methyl sulfate ; 1,6-Dimethyl-3-carbethoxy-4-oxo-6,7,8,9-tetrahydrohomopyrimidazol methylsulphate ; 3-(Ethoxycarbonyl)-6,7,8,9-tetrahydro-1,6-dimethyl-4-oxo-4H-pyrido(1,2-a)pyrimidinium methyl sulfate ; Dolcuran ; EINECS 249-103-4 ; Metilsulfate de rimazolium ; Rimagina ; Rimazolii metilsulfas ; Rimazolium methyl sulfate ; Rimazolium metilsulfate ; Ro 11-780 ; UNII-99YI50276I .
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