Introduction：Basic information about CAS 95211-71-5|7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE |
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| CAS Number | 95211-71-5 | Molecular Weight | 220.29100 |
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| Density | 1.52g/cm3 | Boiling Point | 477.1ºC at 760 mmHg |
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| Molecular Formula | C11H12N2OS | Melting Point | / |
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| MSDS | / | Flash Point | 242.3ºC |
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Names
| Name | 7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.52g/cm3 |
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| Boiling Point | 477.1ºC at 760 mmHg |
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| Molecular Formula | C11H12N2OS |
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| Molecular Weight | 220.29100 |
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| Flash Point | 242.3ºC |
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| Exact Mass | 220.06700 |
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| PSA | 73.99000 |
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| LogP | 2.10940 |
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| Index of Refraction | 1.772 |
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| InChIKey | YSMXTYUERRJGMR-UHFFFAOYSA-N |
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| SMILES | CC1CCc2c(sc3nc[nH]c(=O)c23)C1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DL8355040
- CHEMICAL NAME :
- (1)Benzothieno(2,3-d)pyrimidin-4(1H)-one, 5,6,7,8-tetrahydro-7-methyl-
- CAS REGISTRY NUMBER :
- 95211-71-5
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C11-H12-N2-O-S
- MOLECULAR WEIGHT :
- 220.31
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 :
- Details of toxic effects not reported other than lethal dose value
- 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: 19,420,1984
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Synonyms
| (1)Benzothieno(2,3-d)pyrimidin-4(1H)-one,5,6,7,8-tetrahydro-7-methyl |
| 5,6,7,8-Tetrahydro-7-methyl-(1)benzothieno(2,3-d)pyrimidin-4(1H)-one |
| 7-methyl-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]pyrimidin-4-one |
| 7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4[3H]one |
| 7-methyl-5,6,7,8-tetrahydrobenzo<b>thieno<2,3-d>pyrimidine-4-one |
