Introduction：Basic information about CAS 13754-86-4|1,5,6,7-Tetrahydro-4H-indol-4-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,5,6,7-Tetrahydro-4H-indol-4-one |
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| CAS Number | 13754-86-4 | Molecular Weight | 135.163 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 310.6±11.0 °C at 760 mmHg |
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| Molecular Formula | C8H9NO | Melting Point | 188-190 °C(lit.) |
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| MSDS | ChineseUSA | Flash Point | 149.6±26.7 °C |
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| Symbol |
GHS07 | Signal Word | Warning |
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Names
| Name | 1,5,6,7-Tetrahydro-4H-Indol-4-One |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 310.6±11.0 °C at 760 mmHg |
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| Melting Point | 188-190 °C(lit.) |
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| Molecular Formula | C8H9NO |
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| Molecular Weight | 135.163 |
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| Flash Point | 149.6±26.7 °C |
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| Exact Mass | 135.068420 |
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| PSA | 32.86000 |
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| LogP | 1.14 |
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| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
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| Index of Refraction | 1.592 |
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| InChIKey | KASJZXHXXNEULX-UHFFFAOYSA-N |
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| SMILES | O=C1CCCc2[nH]ccc21 |
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Safety Information
| Symbol |
GHS07 |
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| Signal Word | Warning |
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| Hazard Statements | H315-H319-H335 |
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| Precautionary Statements | P261-P305 + P351 + P338 |
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| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
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| Hazard Codes | Xi: Irritant; |
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| Risk Phrases | R36/37/38 |
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| Safety Phrases | S26-S37/39 |
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| RIDADR | NONH for all modes of transport |
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| WGK Germany | 3 |
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| HS Code | 2933990090 |
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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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Articles4
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| Direct α-iodination of aryl alkyl ketones by elemental iodine activated by 1-chloromethyl-4-fluoro-1, 4-diazoniabicyclo [2.2. 2] octane bis (tetrafluoroborate). Jereb M, et al. Synthesis 06 , 0853-0858, (2003)
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| DNA binders: 1. evaluation of DNA-interactive ability, design, and synthesis of novel intercalating agents Sechi M, et al. Lett. Drug Des. Discov. 6(1) , 56-62, (2009)
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| Synthesis of pyrrolo [1, 2-a] indole-1, 8 (5H)-diones as new synthons for developing novel tricyclic compounds of pharmaceutical interest. Sechi M, et al. ARKIVOC 5 , 97-106, (2004)
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Synonyms
| 4,5,6,7-Tetrahydro-4-oxoindole |
| 6,7-Dihydro-1H-indol-4(5H)-one |
| 1,5,6,7-Tetrahydro-4H-indol-4-one |
| 4-Oxo-4,5,6,7-tetrahydroindole |
| MFCD00075438 |
