p-Toluenesulfonylacetonitrile
Modify Date: 2026-07-01 10:44:46
p-Toluenesulfonylacetonitrile structure
|
Common Name | p-Toluenesulfonylacetonitrile | ||
|---|---|---|---|---|
| CAS Number | 5697-44-9 | Molecular Weight | 195.238 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 400.9±45.0 °C at 760 mmHg | |
| Molecular Formula | C9H9NO2S | Melting Point | 147-151 °C | |
| MSDS | N/A | Flash Point | 196.3±28.7 °C | |
| Name | 4-(Methylphenyl)sulfonylacetonitrile |
|---|---|
| Synonym | More Synonyms |
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 400.9±45.0 °C at 760 mmHg |
| Melting Point | 147-151 °C |
| Molecular Formula | C9H9NO2S |
| Molecular Weight | 195.238 |
| Flash Point | 196.3±28.7 °C |
| Exact Mass | 195.035400 |
| PSA | 66.31000 |
| LogP | 0.77 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.540 |
| InChIKey | BBNNLJMGPASZPD-UHFFFAOYSA-N |
| SMILES | Cc1ccc(S(=O)(=O)CC#N)cc1 |
| Hazard Codes | Xn:Harmful; |
|---|---|
| Risk Phrases | R20/21/22 |
| Safety Phrases | S36/37 |
| RIDADR | 3276 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 2926909090 |
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
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Name: Screen for inhibitors of RMI FANCM (MM2) intereaction
Source: 11908
Target: N/A
External Id: RMI-FANCM-MM2
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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| EINECS 227-173-7 |
| MFCD00039487 |
| 2-(4-methylphenyl)sulfonylacetonitrile |
| [(4-Methylphenyl)sulfonyl]acetonitrile |
| Tosylmethyl Isocyanide- |
| p-Toluenesulfonylacetonitrile |
| p-Tolylsulfonylacetonitrile |
| 2-[(4-methylphenyl)sulfonyl]acetonitrile |