Introduction：Basic information about CAS 120354-21-4|3-METHOXY-4-PYRROLIDIN-1-YL-BENZALDEHYDE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-METHOXY-4-PYRROLIDIN-1-YL-BENZALDEHYDE |
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| CAS Number | 120354-21-4 | Molecular Weight | 249.33200 |
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| Density | 1.53g/cm3 | Boiling Point | 467.6ºC at 760 mmHg |
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| Molecular Formula | C12H15N3OS | Melting Point | / |
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| MSDS | / | Flash Point | 236.6ºC |
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Names
| Name | 3-amino-2,7-dimethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one |
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Chemical & Physical Properties
| Density | 1.53g/cm3 |
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| Boiling Point | 467.6ºC at 760 mmHg |
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| Molecular Formula | C12H15N3OS |
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| Molecular Weight | 249.33200 |
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| Flash Point | 236.6ºC |
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| Exact Mass | 249.09400 |
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| PSA | 89.15000 |
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| LogP | 2.18620 |
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| Vapour Pressure | 6.41E-09mmHg at 25°C |
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| Index of Refraction | 1.767 |
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| InChIKey | CRMSMSNBTURPKP-UHFFFAOYSA-N |
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| SMILES | Cc1nc2sc3c(c2c(=O)n1N)CCC(C)C3 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DL8295000
- CHEMICAL NAME :
- Benzothieno(2,3-d)pyrimidin-4(3H)-one, 5,6,7,8-tetrahydro-3-amino-2,7-dimethyl-
- CAS REGISTRY NUMBER :
- 120354-21-4
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C12-H15-N3-O-S
- MOLECULAR WEIGHT :
- 249.36
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published 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: 23,453,1988
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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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