Introduction：Basic information about CAS 65442-31-1|isobutyl quinoline, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | isobutyl quinoline |
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| CAS Number | 65442-31-1 | Molecular Weight | 185.26 |
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| Density | 1.01g/cm3 | Boiling Point | 288.3ºC at 760 mmHg |
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| Molecular Formula | C13H15N | Melting Point | / |
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| MSDS | / | Flash Point | 117.6ºC |
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Names
| Name | 6-butan-2-ylquinoline |
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| Synonym | More Synonyms |
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isobutyl quinoline BiologicalActivity
| Description | Isobutylquinoleine is a fragrance ingredient[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
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| References | [1]. Stephen D W, et al Fragrance composition. Britain, WO2022214636 A1. 2022-10-13. |
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Chemical & Physical Properties
| Density | 1.01g/cm3 |
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| Boiling Point | 288.3ºC at 760 mmHg |
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| Molecular Formula | C13H15N |
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| Molecular Weight | 185.26 |
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| Flash Point | 117.6ºC |
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| Exact Mass | 185.12000 |
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| PSA | 12.89000 |
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| LogP | 3.74830 |
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| Index of Refraction | 1.579 |
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| InChIKey | AUBLFWWZTFFBNU-UHFFFAOYSA-N |
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| SMILES | CCC(C)c1ccc2ncccc2c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VB0550000
- CAS REGISTRY NUMBER :
- 65442-31-1
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C13-H15-N
- MOLECULAR WEIGHT :
- 185.29
- WISWESSER LINE NOTATION :
- T66 BNJ H1Y1&1 4 &T66 BNJ J1Y1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1020 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 16,661,1978
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Safety Information
Customs
| HS Code | 2933499090 |
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| Summary | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| EINECS 265-777-2 |
| 6-sec-Butylquinoline |
| sec-Butylquinoline |
