Introduction：Basic information about CAS 13111-57-4|psi-Tectorigenin, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | psi-Tectorigenin |
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| CAS Number | 13111-57-4 | Molecular Weight | 300.26300 |
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| Density | 1.512 g/cm3 | Boiling Point | 578.1ºC at 760 mmHg |
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| Molecular Formula | C16H12O6 | Melting Point | / |
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| MSDS | / | Flash Point | 220.9ºC |
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Names
| Name | 5,7-dihydroxy-3-(4-hydroxyphenyl)-8-methoxychromen-4-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.512 g/cm3 |
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| Boiling Point | 578.1ºC at 760 mmHg |
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| Molecular Formula | C16H12O6 |
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| Molecular Weight | 300.26300 |
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| Flash Point | 220.9ºC |
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| Exact Mass | 300.06300 |
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| PSA | 100.13000 |
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| LogP | 2.58540 |
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| Vapour Pressure | 5.78E-14mmHg at 25°C |
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| Index of Refraction | 1.697 |
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| InChIKey | UYLQOGTYNFVQQX-UHFFFAOYSA-N |
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| SMILES | COc1c(O)cc(O)c2c(=O)c(-c3ccc(O)cc3)coc12 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DJ3000000
- CHEMICAL NAME :
- 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxyphenyl)-8-methoxy-
- CAS REGISTRY NUMBER :
- 13111-57-4
- BEILSTEIN REFERENCE NO. :
- 0305254
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C16-H12-O6
- MOLECULAR WEIGHT :
- 300.28
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >250 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 28,947,1975
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Safety Information
Customs
| HS Code | 2914509090 |
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| Summary | HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
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Synonyms
| 4H-1-Benzopyran-4-one,5,7-dihydroxy-3-(4-hydroxyphenyl)-8-methoxy |
| 5,7-Dihydroxy-3-(4-hydroxyphenyl)-8-methoxy-4H-1-benzopyran-4-one |
| Pseudotectorigenin |
| Isoflavone,4',5,7-trihydroxy-8-methoxy-(7CI,8CI) |
| 5,7-Dihydroxy-3-(4-hydroxy-phenyl)-8-methoxy-chromen-4-on |
| tectorigenin |
| 5,7,4'-Trihydroxy-8-methoxyisoflavone |
| 5,7-dihydroxy-3-(4-hydroxy-phenyl)-8-methoxy-chromen-4-one |
| Isotectorigenin |
