Introduction：Basic information about CAS 31139-87-4|Tipepidine hibenzate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Tipepidine hibenzate |
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| CAS Number | 31139-87-4 | Molecular Weight | 517.65900 |
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| Density | 1.193g/cm3 | Boiling Point | 403ºC at 760mmHg |
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| Molecular Formula | C29H27NO4S2 | Melting Point | / |
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| MSDS | / | Flash Point | 197.5ºC |
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Names
| Name | 3-(dithiophen-2-ylmethylidene)-1-methylpiperidine,2-(4-hydroxybenzoyl)benzoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.193g/cm3 |
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| Boiling Point | 403ºC at 760mmHg |
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| Molecular Formula | C29H27NO4S2 |
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| Molecular Weight | 517.65900 |
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| Flash Point | 197.5ºC |
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| Exact Mass | 517.13800 |
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| PSA | 134.32000 |
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| LogP | 6.59640 |
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| InChIKey | KEEAAKGKVVTPOM-UHFFFAOYSA-N |
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| SMILES | CN1CCCC(=C(c2cccs2)c2cccs2)C1.O=C(O)c1ccccc1C(=O)c1ccc(O)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DH1960000
- CAS REGISTRY NUMBER :
- 31139-87-4
- LAST UPDATED :
- 198706
- DATA ITEMS CITED :
- 4
- MOLECULAR FORMULA :
- C15-H17-N-S2.C14-H10-O4
- MOLECULAR WEIGHT :
- 517.69
- WISWESSER LINE NOTATION :
- T6N CYTJ A1 CU1Y- BT5SJ&- BT5SJ &QVR BVQ DQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,463,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1122 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. (Yakugyo Jihosha, Inaoka Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo 101, Japan) V.1- 1959- Volume(issue)/page/year: 24,2331,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 10 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,463,1982
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1440 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. (Yakugyo Jihosha, Inaoka Bldg., 2-36 Jinbo-cho, Kanda, Chiyoda-ku, Tokyo 101, Japan) V.1- 1959- Volume(issue)/page/year: 24,2331,1982
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Safety Information
Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| Asverin (TN) |
| EINECS 250-481-8 |
| Tipepidine hibenzate (JP16) |
| Antupex(Tipepidine hibenzate) |
| tipepidine hibenzate |
| I01-0288 |
| o-(p-hydroxybenzoyl)benzoic acid,compound with 3-(di-2-thienylmethylene)-1-methylpiperidine (1:1) |
