Introduction：Basic information about CAS 2156-27-6|benproperine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | benproperine |
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| CAS Number | 2156-27-6 | Molecular Weight | 309.44500 |
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| Density | 1.04g/cm3 | Boiling Point | 433ºC at 760mmHg |
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| Molecular Formula | C21H27NO | Melting Point | / |
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| MSDS | / | Flash Point | 126.8ºC |
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Names
| Name | benproperine |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.04g/cm3 |
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| Boiling Point | 433ºC at 760mmHg |
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| Molecular Formula | C21H27NO |
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| Molecular Weight | 309.44500 |
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| Flash Point | 126.8ºC |
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| Exact Mass | 309.20900 |
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| PSA | 12.47000 |
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| LogP | 4.46850 |
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| Index of Refraction | 1.5614 (estimate) |
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| InChIKey | JTUQXGZRVLWBCR-UHFFFAOYSA-N |
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| SMILES | CC(COc1ccccc1Cc1ccccc1)N1CCCCC1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- TN1304000
- CHEMICAL NAME :
- Piperidine, 1-(1-methyl-2-((alpha-phenyl-o-tolyl)oxy)ethyl)-
- CAS REGISTRY NUMBER :
- 2156-27-6
- BEILSTEIN REFERENCE NO. :
- 1258822
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C21-H27-N-O
- MOLECULAR WEIGHT :
- 309.49
- WISWESSER LINE NOTATION :
- T6NTJ AY1&1OR B1R
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1087 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: 109,476,1970 ** REPRODUCTIVE DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 6 gm/kg
- SEX/DURATION :
- female 60 day(s) pre-mating
- TOXIC EFFECTS :
- Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 109,476,1970
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Safety Information
Customs
| HS Code | 2933399090 |
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| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 1-O-Benzylphenoxy-2-piperidinopropan |
| pirexyl |
| Benproperin |
