Introduction：Basic information about CAS 21284-11-7|Crotocin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Crotocin |
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| CAS Number | 21284-11-7 | Molecular Weight | 332.39100 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C19H24O5 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | Crotocin |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C19H24O5 |
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| Molecular Weight | 332.39100 |
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| Exact Mass | 332.16200 |
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| PSA | 60.59000 |
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| LogP | 2.15430 |
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| Vapour Pressure | 0mmHg at 25°C |
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| InChIKey | LAQCZBYXNRANFU-PMKNNYEISA-N |
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| SMILES | CC=CC(=O)OC1CC2OC3C=C(C)C4OC4C3(C)C1(C)C21CO1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- YD0117000
- CAS REGISTRY NUMBER :
- 21284-11-7
- LAST UPDATED :
- 199410
- DATA ITEMS CITED :
- 7
- MOLECULAR FORMULA :
- C19-H24-O5
- MOLECULAR WEIGHT :
- 332.43
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - guinea pig
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 810 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA - TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 100 ug/plate
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 38,536,1978
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Safety Information
Synonyms
| 4-Isocrotonyloxy-7,8-epoxyscirp-9-ene |
| Antibiotic T |
| Trichothec-9-en-4-ol,7,8:12,13-diepoxy-,(2Z)-2-butenoate,(4beta,7beta,8beta) |
