2-Benzothiazolecarboxylicacid,methylester(9CI)
2-Benzothiazolecarboxylicacid,methylester(9CI) structure
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Common Name | 2-Benzothiazolecarboxylicacid,methylester(9CI) | ||
|---|---|---|---|---|
| CAS Number | 87802-07-1 | Molecular Weight | 193.22200 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C9H7NO2S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: Methyl 1,3-benzothiazole-2-carboxylate (CAS号：87802-07-1, molecular formula: C9H7NO2S, molecular weight: 193.22200) For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Methyl 1,3-benzothiazole-2-carboxylate |
|---|---|
| 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.
| Molecular Formula | C9H7NO2S |
|---|---|
| Molecular Weight | 193.22200 |
| Exact Mass | 193.02000 |
| PSA | 67.43000 |
| LogP | 2.08290 |
| InChIKey | NGYIWFTZUHRKSF-UHFFFAOYSA-N |
| SMILES | COC(=O)c1nc2ccccc2s1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934200090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
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| DownStream 0 | |
![Benzo[d]thiazole Structure](https://image.chemsrc.com/caspic/318/95-16-9.png)
CAS#:95-16-9
CAS#:124-38-9
CAS#:74-88-4
CAS#:18370-95-1
CAS#:137-07-5
CAS#:600-23-7
CAS#:67-56-1
CAS#:28891-34-1
CAS#:1224627-75-1
CAS#:3622-04-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934200090 |
|---|---|
| Summary | 2934200090. other compounds containing in the structure a benzothiazole 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% |
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: 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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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| methyl 2-benzothiazolecarboxylate |
| Methyl benzo[d]thiazole-2-carboxylate |
| 2-methoxycarbonylbenzothiazole |
| benzothiazole-2-carboxylic acid methyl ester |
| HMS2378N16 |
| benzothiazol-2-carboxylic acid methyl ester |
| methyl benzothiazole-2-carboxylate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the English name of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: The English name of Methyl 1,3-benzothiazole-2-carboxylate is Methyl 1,3-benzothiazole-2-carboxylate. |
| Q: What is the SMILES notation of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: SMILES notation of Methyl 1,3-benzothiazole-2-carboxylate is COC(=O)c1nc2ccccc2s1. |
| Q: What is the molecular formula of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: Molecular formula of Methyl 1,3-benzothiazole-2-carboxylate is C9H7NO2S. |
| Q: What is the Chinese name of 87802-07-1? |
| A: Chinese name of 87802-07-1 is 87802-07-1. |
| Q: What is the molecular weight of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: Molecular weight of Methyl 1,3-benzothiazole-2-carboxylate is 193.22200. |
| Q: What are the upstream materials of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: Related upstream materials(CAS) of Methyl 1,3-benzothiazole-2-carboxylate: 95-16-9;124-38-9;74-88-4;18370-95-1;137-07-5;600-23-7;67-56-1;28891-34-1;1224627-75-1;3622-04-6. |
| Q: What is the CAS number of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: CAS number of Methyl 1,3-benzothiazole-2-carboxylate is 87802-07-1. |
| Q: What is the polar surface area (PSA) of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: Polar surface area (PSA) of Methyl 1,3-benzothiazole-2-carboxylate is 67.43000. |
| Q: What English synonyms does Methyl 1,3-benzothiazole-2-carboxylate have? |
| A: English synonyms of Methyl 1,3-benzothiazole-2-carboxylate: methyl 2-benzothiazolecarboxylate, Methyl benzo[d]thiazole-2-carboxylate, 2-methoxycarbonylbenzothiazole, benzothiazole-2-carboxylic acid methyl ester, HMS2378N16, benzothiazol-2-carboxylic acid methyl ester, methyl benzothiazole-2-carboxylate. |
| Q: What is the InChIKey of Methyl 1,3-benzothiazole-2-carboxylate? |
| A: InChIKey of Methyl 1,3-benzothiazole-2-carboxylate is NGYIWFTZUHRKSF-UHFFFAOYSA-N. |
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. |