Introduction：Basic information about CAS 133-15-3|Calcium para-aminosalicylate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Calcium para-aminosalicylate |
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| CAS Number | 133-15-3 | Molecular Weight | 173.18 |
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| Density | 1.491g/cm3 | Boiling Point | 380.8ºC at 760 mmHg |
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| Molecular Formula | C7H7NO3.1/2Ca | Melting Point | 150-151ºC, with effervescence |
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| MSDS | / | Flash Point | 184.1ºC |
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Names
| Name | 4-Amino-2-hydroxybenzoic Acid Calcium Salt Heptahydrate |
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| Synonym | More Synonyms |
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Calcium para-aminosalicylate BiologicalActivity
| Description | 4-Aminosalicylic acid hemicalcium is an orally active antibiotic and has the potential for tuberculosis research[1]. |
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| Related Catalog | Research Areas >>InfectionResearch Areas >>Inflammation/ImmunologySignaling Pathways >>Anti-infection >>Bacterial |
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| References | [1]. Vânia André, et al. Crystal Forms of the Antibiotic 4-Aminosalicylic Acid: Solvates and Molecular Salts with Dioxane, Morpholine, and Piperazine. Cryst. Growth Des. 2009, 9, 12, 5108-5116. |
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Chemical & Physical Properties
| Density | 1.491g/cm3 |
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| Boiling Point | 380.8ºC at 760 mmHg |
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| Melting Point | 150-151ºC, with effervescence |
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| Molecular Formula | C7H7NO3.1/2Ca |
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| Molecular Weight | 173.18 |
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| Flash Point | 184.1ºC |
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| Exact Mass | 344.032135 |
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| PSA | 145.10000 |
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| LogP | 2.35340 |
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| InChIKey | CWFBAYJKRMBLJJ-UHFFFAOYSA-L |
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| SMILES | Nc1ccc(C(=O)O)c([O-])c1.Nc1ccc(C(=O)O)c([O-])c1.O.O.O.O.O.O.O.[Ca+2] |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VO1470000
- CAS REGISTRY NUMBER :
- 133-15-3
- LAST UPDATED :
- 198909
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C14-H12-N2-O6.Ca
- MOLECULAR WEIGHT :
- 344.36
- WISWESSER LINE NOTATION :
- ZR CQ DVO 2 &-CA-
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 6500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ZENBAX Zeitschrift fuer Naturforschung, Teil B: Anorganische Chemie, Organische Chemie, Biochemie, Biophysik, Biologie. (Tuebingen, Fed. Rep. Ger.) V.2B-27B, 1947-1972. For publisher information, see ZNCBDA. Volume(issue)/page/year: 6B,183,1951
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ZENBAX Zeitschrift fuer Naturforschung, Teil B: Anorganische Chemie, Organische Chemie, Biochemie, Biophysik, Biologie. (Tuebingen, Fed. Rep. Ger.) V.2B-27B, 1947-1972. For publisher information, see ZNCBDA. Volume(issue)/page/year: 6B,183,1951
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Safety Information
| RTECS | VO1470000 |
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| HS Code | 2918230000 |
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Customs
| HS Code | 2918230000 |
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| Summary | 2918230000 other esters of salicylic acid and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| Calcium para-aminosalicylate |
| UNII-73I4QDW01W |
| Benzoic acid, 4-amino-2-hydroxy-, calcium salt (2:1) |
| 4-Aminosalicylic Acid Calcium Salt Heptahydrate |
| Calcium 4-aminosalicylate |
| EINECS 205-095-4 |
| Nippas Calcium |
| Dicalcium Bis(4-aminosalicylate) Heptahydrate |
| MFCD04038035 |
| Calcium p-aminosalicylate |
| Monocalcium p-aminosalicylate |
| calcium 4-amino-2-hydroxybenzoate |
| Calcium bis(4-amino-2-hydroxybenzoate) |
| calcium bis(4-aminosalicylate) |
