Introduction：Basic information about CAS 90729-41-2|Oxodipine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Oxodipine |
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| CAS Number | 90729-41-2 | Molecular Weight | 359.37300 |
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| Density | 1.247g/cm3 | Boiling Point | 470ºC at 760 mmHg |
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| Molecular Formula | C19H21NO6 | Melting Point | / |
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| MSDS | / | Flash Point | 238ºC |
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Names
| Name | 5-O-ethyl 3-O-methyl 4-(1,3-benzodioxol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.247g/cm3 |
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| Boiling Point | 470ºC at 760 mmHg |
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| Molecular Formula | C19H21NO6 |
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| Molecular Weight | 359.37300 |
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| Flash Point | 238ºC |
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| Exact Mass | 359.13700 |
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| PSA | 83.09000 |
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| LogP | 2.71500 |
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| Index of Refraction | 1.552 |
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| InChIKey | MSOAVHHAZCMHDI-UHFFFAOYSA-N |
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| SMILES | CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cccc2c1OCO2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- US7968500
- CHEMICAL NAME :
- 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(1,3-benzodioxol-4-yl)-2,6-dimethyl-, ethyl methyl ester
- CAS REGISTRY NUMBER :
- 90729-41-2
- LAST UPDATED :
- 199406
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C19-H21-N-O6
- MOLECULAR WEIGHT :
- 359.41
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 12,633,1987
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 150 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FATOAO Farmakologiya i Toksikologiya (Moscow). For English translation, see PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2- 1939- Volume(issue)/page/year: 54(2),40,1991 ** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 2160 mg/kg/13W-I
- TOXIC EFFECTS :
- Vascular - BP lowering not characterized in autonomic section Endocrine - other changes Endocrine - changes in adrenal weight
- REFERENCE :
- TOPADD Toxicologic Pathology. (c/o Dr. F.A. de la Iglesia, Warner-Lambert Co., Pharmaceutical Research Div., POB 1047, Ann Arbor, MI 48106) V.6(3/4)- 1978- Volume(issue)/page/year: 20,549,1992
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Synonyms
| Oxodipinum |
| IQB-837-V |
| Oxodipino [Spanish] |
| Oxodipinum [Latin] |
| Oxodipine [INN] |
| 3,5-Pyridinedicarboxylic acid,1,4-dihydro-4-(1,3-benzodioxol-4-yl)-2,6-dimethyl-,ethyl methyl ester |
| Ethyl methyl 1,4-dihydro-2,6-dimethyl-4-(2,3-(methylenedioxy)phenyl)-3,5-pyridinedicarboxylate |
| OXODIPINE |
| Oxodipino |
