Introduction：Basic information about CAS 86111-26-4|D 16726, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | D 16726 |
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| CAS Number | 86111-26-4 | Molecular Weight | 351.39600 |
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| Density | 1.17g/cm3 | Boiling Point | 508.3ºC at 760 mmHg |
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| Molecular Formula | C21H21NO4 | Melting Point | / |
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| MSDS | / | Flash Point | 261.2ºC |
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Names
| Name | [4-(5-acetyloxy-1-ethyl-3-methylindol-2-yl)phenyl] acetate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.17g/cm3 |
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| Boiling Point | 508.3ºC at 760 mmHg |
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| Molecular Formula | C21H21NO4 |
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| Molecular Weight | 351.39600 |
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| Flash Point | 261.2ºC |
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| Exact Mass | 351.14700 |
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| PSA | 57.53000 |
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| LogP | 4.48720 |
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| Index of Refraction | 1.577 |
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| InChIKey | KSZGVNZSUJHOJA-UHFFFAOYSA-N |
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| SMILES | CCn1c(-c2ccc(OC(C)=O)cc2)c(C)c2cc(OC(C)=O)ccc21 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NM2445000
- CHEMICAL NAME :
- 1H-Indol-5-ol, 2-(4-(acetyloxy)phenyl)-1-ethyl-3-methyl-, acetate (ester)
- CAS REGISTRY NUMBER :
- 86111-26-4
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C21-H21-N-O4
- MOLECULAR WEIGHT :
- 351.43
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,281,1985
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 10,281,1985
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Safety Information
Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| Zindoxifenum [Latin] |
| 1H-Indol-5-ol,2-(4-(acetyloxy)phenyl)-1-ethyl-3-methyl-,acetate (ester) |
| Zindoxifeno [Spanish] |
| 5-Acetoxy-2-(4-acetoxyphenyl)-1-ethyl-3-methylindole |
| 2-(4-(Acetyloxy)phenyl)-1-ethyl-3-methyl-1H-indol-5-ol acetate (ester) |
| Zindoxifene |
