Introduction:Basic information about CAS 16034-77-8|iocetamic acid (200 mg), including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | iocetamic acid (200 mg) |
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| CAS Number | 16034-77-8 | Molecular Weight | 613.95700 |
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| Density | 2.416g/cm3 | Boiling Point | 658.2ºC at 760 mmHg |
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| Molecular Formula | C12H13I3N2O3 | Melting Point | 224-225ºC |
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| MSDS | / | Flash Point | 351.9ºC |
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Names
| Name | 3-(N-acetyl-3-amino-2,4,6-triiodoanilino)-2-methylpropanoic acid |
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| Synonym | More Synonyms |
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iocetamic acid (200 mg) BiologicalActivity
| Description | Cholebrine (DRC 1201), a diagnostic aid, is an orally active chotecystographic contrast agent[1]. |
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| Related Catalog | Research Areas >>OthersSignaling Pathways >>Others >>Others |
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| In Vivo | Cholebrine 在大鼠中 LD50 为 7 g/kg (口服) 和 0.7 g/kg (静脉注射)[2]. |
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| References | [1]. Owen JP, et al. Comparative study of iocetamic acid and calcium ipodate in the visualisation of the gallbladder and common bile duct. Clin Radiol. 1978 Sep;29(5):535-40. [2]. Janbroers JM, et al. Toxicologic studies of iocetamic acid in rats and dogs. Toxicol Appl Pharmacol. 1969 Mar;14(2):242-8. |
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Chemical & Physical Properties
| Density | 2.416g/cm3 |
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| Boiling Point | 658.2ºC at 760 mmHg |
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| Melting Point | 224-225ºC |
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| Molecular Formula | C12H13I3N2O3 |
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| Molecular Weight | 613.95700 |
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| Flash Point | 351.9ºC |
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| Exact Mass | 613.80600 |
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| PSA | 83.63000 |
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| LogP | 3.73740 |
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| Vapour Pressure | 3.21E-18mmHg at 25°C |
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| Index of Refraction | 1.75 |
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| InChIKey | GSVQIUGOUKJHRC-UHFFFAOYSA-N |
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| SMILES | CC(=O)N(CC(C)C(=O)O)c1c(I)cc(I)c(N)c1I |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UE6050000
- CHEMICAL NAME :
- Propionic acid, 3-(acetyl-(3-amino-2,4,6-triiodophenyl)amino)-2-methy l-
- CAS REGISTRY NUMBER :
- 16034-77-8
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C12-H13-I3-N2-O3
- MOLECULAR WEIGHT :
- 613.97
- WISWESSER LINE NOTATION :
- ZR BI DI FI CNV1&1Y1&VQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 7100 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - acute pulmonary edema Gastrointestinal - other changes
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,232,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 700 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - acute pulmonary edema Gastrointestinal - other changes
- REFERENCE :
- TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 14,232,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 410 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 13,997,1970 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6131 No. of Facilities: 10 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 260 (estimated) No. of Female Employees: 140 (estimated)
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Safety Information
Customs
| HS Code | 2924299090 |
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| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| Cholimil |
| DRC 1201 |
| Acide iocetamique [INN-French] |
| N-(3-amino-2,4,6-triiodophenyl)-3-acetamido-2-methyl-propionic acid |
| Colebrina |
| IOCETAMIC ACID |
| Acidum jocetamicum |
| Iocetamsaeure |
| Acidum iocetamicum [INN-Latin] |
| Cholebrine |
| Acido iocetamico [INN-Spanish] |