Introduction:Basic information about CAS 5919-29-9|Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(acetylamino)-, ethyl ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(acetylamino)-, ethyl ester |
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| CAS Number | 5919-29-9 | Molecular Weight | 267.34400 |
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| Density | 1.253g/cm3 | Boiling Point | 492.9ºC at 760 mmHg |
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| Molecular Formula | C13H17NO3S | Melting Point | / |
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| MSDS | / | Flash Point | 251.9ºC |
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Names
| Name | ethyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.253g/cm3 |
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| Boiling Point | 492.9ºC at 760 mmHg |
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| Molecular Formula | C13H17NO3S |
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| Molecular Weight | 267.34400 |
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| Flash Point | 251.9ºC |
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| Exact Mass | 267.09300 |
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| PSA | 83.64000 |
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| LogP | 2.83500 |
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| Index of Refraction | 1.591 |
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| InChIKey | MYGDFSFTVVUJHF-UHFFFAOYSA-N |
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| SMILES | CCOC(=O)c1c(NC(C)=O)sc2c1CCCC2 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DL9603600
- CHEMICAL NAME :
- Benzo(b)thiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-(acetylamino)-, ethyl ester
- CAS REGISTRY NUMBER :
- 5919-29-9
- BEILSTEIN REFERENCE NO. :
- 1318072
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H17-N-O3-S
- MOLECULAR WEIGHT :
- 267.37
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >1 gm/kg
- TOXIC EFFECTS :
- Sense Organs and Special Senses (Eye) - ptosis Behavioral - changes in motor activity (specific assay) Lungs, Thorax, or Respiration - respiratory depression
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,413,1980
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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
| 2-acetylamino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester |
| 2-acetamido-3-carboethoxy-4,5-tetramethylenethiophene |
| ethyl 2-(acetylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate |
| Ethyl 4,5,6,7-tetrahydro-2-(acetylamino)benzo(b)thiophene-3-carboxylate |
| 2-Acetylamino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester |
| ethyl 2-(acetylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Benzo(b)thiophene-3-carboxylic acid,4,5,6,7-tetrahydro-2-(acetylamino)-,ethyl ester |
| ethyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate |