1-Propanone,3-chloro-1-(10H-phenothiazin-10-yl)
1-Propanone,3-chloro-1-(10H-phenothiazin-10-yl) structure
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Common Name | 1-Propanone,3-chloro-1-(10H-phenothiazin-10-yl) | ||
|---|---|---|---|---|
| CAS Number | 4091-91-2 | Molecular Weight | 289.78000 | |
| Density | 1.343g/cm3 | Boiling Point | 513.7ºC at 760mmHg | |
| Molecular Formula | C15H12ClNOS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 264.5ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-chloro-1-phenothiazin-10-ylpropan-1-one |
|---|---|
| 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 | 1.343g/cm3 |
|---|---|
| Boiling Point | 513.7ºC at 760mmHg |
| Molecular Formula | C15H12ClNOS |
| Molecular Weight | 289.78000 |
| Flash Point | 264.5ºC |
| Exact Mass | 289.03300 |
| PSA | 45.61000 |
| LogP | 4.50980 |
| Index of Refraction | 1.659 |
| InChIKey | QDMBCNDXWXEIAF-UHFFFAOYSA-N |
| SMILES | O=C(CCCl)N1c2ccccc2Sc2ccccc21 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi: Irritant; |
|---|---|
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~89%
1-Propanone,3-c... CAS#:4091-91-2 |
| Literature: Sarmiento, Gabriela P.; Vitale, Roxana G.; Afeltra, Javier; Moltrasio, Graciela Y.; Moglioni, Albertina G. European Journal of Medicinal Chemistry, 2011 , vol. 46, # 1 p. 101 - 105 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 1 | |
CAS#:3576-44-1This 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: Antifungal activity against Cladophialophora carrionii by microdilution test
Source: ChEMBL
Target: N/A
External Id: CHEMBL1664801
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Name: Antifungal activity against Exophiala spinifera by microdilution test
Source: ChEMBL
Target: Exophiala spinifera
External Id: CHEMBL1664802
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Name: Antifungal activity against Exophiala oligosperma by microdilution test
Source: ChEMBL
Target: N/A
External Id: CHEMBL1664803
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Name: Antifungal activity against Exophiala xenobiotica by microdilution test
Source: ChEMBL
Target: N/A
External Id: CHEMBL1664804
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Name: Antifungal activity against Candida krusei by microdilution test
Source: ChEMBL
Target: Pichia kudriavzevii
External Id: CHEMBL1664793
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Name: Antifungal activity against Candida guilliermondii by microdilution test
Source: ChEMBL
Target: Meyerozyma guilliermondii
External Id: CHEMBL1664794
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Name: Antifungal activity against Cryptococcus neoformans by microdilution test
Source: ChEMBL
Target: Cryptococcus neoformans
External Id: CHEMBL1664795
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Name: Antifungal activity against Aspergillus fumigates by microdilution test
Source: ChEMBL
Target: NON-PROTEIN TARGET
External Id: CHEMBL1664796
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Name: Antifungal activity against Aspergillus flavus by microdilution test
Source: ChEMBL
Target: Aspergillus flavus
External Id: CHEMBL1664797
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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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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Chloro-1-phenothiazin-10-yl-propan-1-one |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: CAS number of 3-chloro-1-phenothiazin-10-ylpropan-1-one is 4091-91-2. |
| Q: What is the boiling point of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Boiling point of 3-chloro-1-phenothiazin-10-ylpropan-1-one is 513.7ºC at 760mmHg. |
| Q: What is the molecular formula of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Molecular formula of 3-chloro-1-phenothiazin-10-ylpropan-1-one is C15H12ClNOS. |
| Q: What are the upstream materials of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Related upstream materials(CAS) of 3-chloro-1-phenothiazin-10-ylpropan-1-one: 92-84-2;625-36-5. |
| Q: What English synonyms does 3-chloro-1-phenothiazin-10-ylpropan-1-one have? |
| A: English synonyms of 3-chloro-1-phenothiazin-10-ylpropan-1-one: 3-Chloro-1-phenothiazin-10-yl-propan-1-one. |
| Q: What is the polar surface area (PSA) of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Polar surface area (PSA) of 3-chloro-1-phenothiazin-10-ylpropan-1-one is 45.61000. |
| Q: What is the SMILES notation of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: SMILES notation of 3-chloro-1-phenothiazin-10-ylpropan-1-one is O=C(CCCl)N1c2ccccc2Sc2ccccc21. |
| Q: What is the molecular weight of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Molecular weight of 3-chloro-1-phenothiazin-10-ylpropan-1-one is 289.78000. |
| Q: What is the InChIKey of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: InChIKey of 3-chloro-1-phenothiazin-10-ylpropan-1-one is QDMBCNDXWXEIAF-UHFFFAOYSA-N. |
| Q: What are the downstream products of 3-chloro-1-phenothiazin-10-ylpropan-1-one? |
| A: Related downstream products(CAS) of 3-chloro-1-phenothiazin-10-ylpropan-1-one: 3576-44-1. |
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. |