p-Toluenesulfonylacetic acid structure
|
Common Name | p-Toluenesulfonylacetic acid | ||
|---|---|---|---|---|
| CAS Number | 3937-96-0 | Molecular Weight | 214.23800 | |
| Density | 1.35 g/cm3 | Boiling Point | 450.4ºC at 760 mmHg | |
| Molecular Formula | C9H10O4S | Melting Point | 117 °C | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 4-toluenesulfonylacetic acid |
|---|---|
| Synonym | More Synonyms |
| Density | 1.35 g/cm3 |
|---|---|
| Boiling Point | 450.4ºC at 760 mmHg |
| Melting Point | 117 °C |
| Molecular Formula | C9H10O4S |
| Molecular Weight | 214.23800 |
| Exact Mass | 214.03000 |
| PSA | 79.82000 |
| LogP | 1.93410 |
| InChIKey | AQDHXMBUTDLAMD-UHFFFAOYSA-N |
| SMILES | Cc1ccc(S(=O)(=O)CC(=O)O)cc1 |
| Hazard Codes | Xi |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/37/39 |
| HS Code | 2916399090 |
| Precursor 9 | |
|---|---|
| DownStream 7 | |
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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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: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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| MFCD00021764 |
| 2-(4-methylphenyl)sulfonylacetic acid |
| EINECS 223-518-0 |
| 2-(p-Toluenesulfonyl)acetic Acid |