2-Amino-6-fluorobenzothiazole
2-Amino-6-fluorobenzothiazole structure
|
Common Name | 2-Amino-6-fluorobenzothiazole | ||
|---|---|---|---|---|
| CAS Number | 348-40-3 | Molecular Weight | 168.191 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 312.0±34.0 °C at 760 mmHg | |
| Molecular Formula | C7H5FN2S | Melting Point | 183-185 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 142.5±25.7 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-fluoro-1,3-benzothiazol-2-amine |
|---|---|
| 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 | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 312.0±34.0 °C at 760 mmHg |
| Melting Point | 183-185 °C(lit.) |
| Molecular Formula | C7H5FN2S |
| Molecular Weight | 168.191 |
| Flash Point | 142.5±25.7 °C |
| Exact Mass | 168.015747 |
| PSA | 67.15000 |
| LogP | 1.94 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.726 |
| InChIKey | CJLUXPZQUXVJNF-UHFFFAOYSA-N |
| SMILES | Nc1nc2ccc(F)cc2s1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R22;R36/37/38 |
| Safety Phrases | S26-S37/39-S36/37/39 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~88%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Thaker; Chothani; Patel; Dhimmar; Solanki; Patel, Neeraj; Makawana Molecular Crystals and Liquid Crystals, 2013 , vol. 575, # 1 p. 64 - 76 |
|
~82%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Charris, Jaime; Monasterios, Melina; Dominguez, Josee; Infante, Wilson; Castro, Norma De Heterocyclic Communications, 2002 , vol. 8, # 3 p. 275 - 280 |
|
~42%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Jacquot, Yves; Cleeren, Anny; Laios, Ioanna; Ma, Yan; Boulahdour, Athem; Bermont, Laurent; Refouvelet, Bernard; Adessi, Gerard; Leclercq, Guy; Xicluna, Alain Biological and Pharmaceutical Bulletin, 2002 , vol. 25, # 3 p. 335 - 341 |
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~%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: US2061186 , ; |
|
~%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Bioorganic and Medicinal Chemistry, , vol. 14, # 16 p. 5678 - 5682 |
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~%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Die Pharmazie, , vol. 22, # 6 p. 229 - 233 |
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~%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Journal of the Indian Chemical Society, , vol. 8, p. 147,163 |
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~%
2-Amino-6-fluor... CAS#:348-40-3 |
| Literature: Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, , vol. 27, # 1-12 p. 189 - 190 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 10 | |
CAS#:399-74-6
CAS#:263239-23-2
CAS#:80087-71-4
CAS#:63754-96-1
CAS#:100638-20-8
CAS#:33264-82-3
CAS#:16194-64-2
CAS#:152937-04-7
CAS#:118220-71-6
CAS#:761450-22-0This 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: 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: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: Tested for the protection against glutamic acid-evoked convulsions in rats by intrape...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL783725
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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
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 6-Fluoro-1,3-benzothiazol-2-amine |
| 2-amino-6-fluorobenzthiazole |
| 6-Fluorobenzo[d]thiazol-2-amine |
| MFCD00013336 |
| 2-Amino-6-fluorobenzothiazole |
| 2-amino-6-fluoro-1,3-benzothiazole |
| 6-fluoro-2-amino-1,3-benzothiazole |
| 6-fluorobenzothiazole-2-ylamine |
| 2-amino-6-fluoro-benzothiazole |
| 6-fluoro-benzothiazol-2-ylamine |
| 6-fluoro-2-benzothiazolamine |
| 2-Benzothiazolamine,6-fluoro |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Related downstream products(CAS) of 6-fluoro-1,3-benzothiazol-2-amine: 399-74-6;263239-23-2;80087-71-4;63754-96-1;100638-20-8;33264-82-3;16194-64-2;152937-04-7;118220-71-6;761450-22-0. |
| Q: What is the boiling point of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Boiling point of 6-fluoro-1,3-benzothiazol-2-amine is 312.0±34.0 °C at 760 mmHg. |
| Q: What is the molecular formula of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Molecular formula of 6-fluoro-1,3-benzothiazol-2-amine is C7H5FN2S. |
| Q: What is the LogP of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: LogP of 6-fluoro-1,3-benzothiazol-2-amine is 1.94. |
| Q: What is the InChIKey of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: InChIKey of 6-fluoro-1,3-benzothiazol-2-amine is CJLUXPZQUXVJNF-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Polar surface area (PSA) of 6-fluoro-1,3-benzothiazol-2-amine is 67.15000. |
| Q: What are the upstream materials of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Related upstream materials(CAS) of 6-fluoro-1,3-benzothiazol-2-amine: 333-20-0;371-40-4;459-05-2;2146-07-8;540-72-7;1544-68-9;1111-67-7. |
| Q: What is the safety information for 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Safety information for 6-fluoro-1,3-benzothiazol-2-amine: S26-S37/39-S36/37/39. |
| Q: What is the SMILES notation of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: SMILES notation of 6-fluoro-1,3-benzothiazol-2-amine is Nc1nc2ccc(F)cc2s1. |
| Q: What is the melting point of 6-fluoro-1,3-benzothiazol-2-amine? |
| A: Melting point of 6-fluoro-1,3-benzothiazol-2-amine is 183-185 °C(lit.). |
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. |