4,5-Dimethylthiophene-2-carboxylicacid
4,5-Dimethylthiophene-2-carboxylicacid structure
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Common Name | 4,5-Dimethylthiophene-2-carboxylicacid | ||
|---|---|---|---|---|
| CAS Number | 40808-24-0 | Molecular Weight | 156.20200 | |
| Density | 1.259 g/cm3 | Boiling Point | 290.6ºC at 760 mmHg | |
| Molecular Formula | C7H8O2S | Melting Point | 206-211°C | |
| MSDS | N/A | Flash Point | 129.5ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4,5-Dimethylthiophene-2-carboxylic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.259 g/cm3 |
|---|---|
| Boiling Point | 290.6ºC at 760 mmHg |
| Melting Point | 206-211°C |
| Molecular Formula | C7H8O2S |
| Molecular Weight | 156.20200 |
| Flash Point | 129.5ºC |
| Exact Mass | 156.02500 |
| PSA | 65.54000 |
| LogP | 2.06310 |
| InChIKey | RZCDKLUMNAKVFB-UHFFFAOYSA-N |
| SMILES | Cc1cc(C(=O)O)sc1C |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| Risk Phrases | R36 |
| Safety Phrases | S26 |
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4,5-Dimethylthi... CAS#:40808-24-0 |
| Literature: Sice Journal of Organic Chemistry, 1954 , vol. 19, p. 70,72 |
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4,5-Dimethylthi... CAS#:40808-24-0 |
| Literature: Lozac'h; Mollier Bulletin de la Societe Chimique de France, 1959 , p. 1389 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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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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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| MFCD00512748 |
| 4,5-dimethylthiophene-2-carboxylic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: InChIKey of 4,5-Dimethylthiophene-2-carboxylic acid is RZCDKLUMNAKVFB-UHFFFAOYSA-N. |
| Q: What is the boiling point of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: Boiling point of 4,5-Dimethylthiophene-2-carboxylic acid is 290.6ºC at 760 mmHg. |
| Q: What is the LogP of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: LogP of 4,5-Dimethylthiophene-2-carboxylic acid is 2.06310. |
| Q: What is the safety information for 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: Safety information for 4,5-Dimethylthiophene-2-carboxylic acid: S26. |
| Q: What is the melting point of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: Melting point of 4,5-Dimethylthiophene-2-carboxylic acid is 206-211°C. |
| Q: What is the molecular formula of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: Molecular formula of 4,5-Dimethylthiophene-2-carboxylic acid is C7H8O2S. |
| Q: What is the polar surface area (PSA) of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: Polar surface area (PSA) of 4,5-Dimethylthiophene-2-carboxylic acid is 65.54000. |
| Q: What English synonyms does 4,5-Dimethylthiophene-2-carboxylic acid have? |
| A: English synonyms of 4,5-Dimethylthiophene-2-carboxylic acid: MFCD00512748, 4,5-dimethylthiophene-2-carboxylic acid. |
| Q: What is the CAS number of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: CAS number of 4,5-Dimethylthiophene-2-carboxylic acid is 40808-24-0. |
| Q: What is the SMILES notation of 4,5-Dimethylthiophene-2-carboxylic acid? |
| A: SMILES notation of 4,5-Dimethylthiophene-2-carboxylic acid is Cc1cc(C(=O)O)sc1C. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |