Introduction：Basic information about CAS 17696-69-4|Hematoporphyrin (dihydrochloride), including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Hematoporphyrin (dihydrochloride) |
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| CAS Number | 17696-69-4 | Molecular Weight | 671.611 |
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| Density | / | Boiling Point | 1192.7ºC at 760 mmHg |
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| Molecular Formula | C34H40Cl2N4O6 | Melting Point | / |
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| MSDS | / | Flash Point | 675.1ºC |
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Names
| Name | Hematoporphyrin IX dihydrochloride,8,13-Bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-21H,23H-porphine-2,18-dipropionic acid dihydrochloride |
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| Synonym | More Synonyms |
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Hematoporphyrin (dihydrochloride) BiologicalActivity
| Description | Hematoporphyrin dihydrochloride is a substrate for affinity chromatography of heme-binding proteins.Target: OthersHematoporphyrin is used for affinity chromatography of heme-binding proteins. Hematoporphyrin is used in the characterization and synthesis of hematoporphyrin- and hematin-agarose [1]. |
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| Related Catalog | Signaling Pathways >>Others >>OthersResearch Areas >>Others |
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| References | [1]. Olsen, K.W., Affinity chromatography of heme-binding proteins: synthesis and characterization of hematin- and hematoporphyrin-agarose. Methods Enzymol, 1986. 123: p. 324-31. |
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Chemical & Physical Properties
| Boiling Point | 1192.7ºC at 760 mmHg |
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| Molecular Formula | C34H40Cl2N4O6 |
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| Molecular Weight | 671.611 |
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| Flash Point | 675.1ºC |
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| Exact Mass | 670.232483 |
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| PSA | 171.36000 |
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| LogP | 4.24970 |
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| Vapour Pressure | 0mmHg at 25°C |
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| InChIKey | DZEVQAVOSKHDRL-UHFFFAOYSA-N |
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| SMILES | CC1=C(CCC(=O)O)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C(C)O)c5C)C(C(C)O)=C4C)c(C)c3CCC(=O)O.Cl.Cl |
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| Storage condition | 2-8°C |
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| Water Solubility | Insoluble in water. Soluble in pyridine (5%). |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- TS5505000
- CHEMICAL NAME :
- 2,18-Porphinedipropionic acid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-, dihydrochloride
- CAS REGISTRY NUMBER :
- 17696-69-4
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C34-H38-N4-O6.2Cl-H
- MOLECULAR WEIGHT :
- 671.68
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >3 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 117,145,1978
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 278 mg/kg
- TOXIC EFFECTS :
- Behavioral - tremor Behavioral - changes in motor activity (specific assay) Nutritional and Gross Metabolic - body temperature decrease
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 117,145,1978
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >1300 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 117,145,1978
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 169 mg/kg
- TOXIC EFFECTS :
- Behavioral - tremor Behavioral - changes in motor activity (specific assay) Nutritional and Gross Metabolic - body temperature decrease
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 117,145,1978
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Safety Information
| Risk Phrases | R33 |
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| RTECS | TS5505000 |
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Synonyms
| MFCD00013470 |
| 21H,23H-Porphine-2,18-dipropanoic acid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-, hydrochloride (1:2) |
| HEMATOPORPHYRIN DIHYDROCHLORIDE |
| EINECS 241-699-4 |
| 3,3'-[7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethylporphyrin-2,18-diyl]dipropanoic acid dihydrochloride |
| 3,3'-[7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropanoic acid dihydrochloride |
| HAEMATOPORPHYRIN DIHYDROCHLORIDE |
| acido1,3,5,8-tetrametil-2,4-bis(idrossietil)porpfina-6,7-dipropionicodiclor |
| Hematoporphyrin (dihydrochloride) |
