1-(4-CHLOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)-ETHANONE
1-(4-CHLOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)-ETHANONE structure
|
Common Name | 1-(4-CHLOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)-ETHANONE | ||
|---|---|---|---|---|
| CAS Number | 58905-19-4 | Molecular Weight | 221.64300 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H8ClN3O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone (CAS number: 58905-19-4, molecular formula: C10H8ClN3O, molecular weight: 221.64300) 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 | 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone |
|---|---|
| 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 | C10H8ClN3O |
|---|---|
| Molecular Weight | 221.64300 |
| Exact Mass | 221.03600 |
| PSA | 47.78000 |
| LogP | 1.81440 |
| InChIKey | ZDGXDQYBMSMZLC-UHFFFAOYSA-N |
| SMILES | O=C(Cn1cncn1)c1ccc(Cl)cc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
![1-(4-chloro-phenyl)-3-phenyl-2-[1,2,4]triazol-1-yl-butan-1-one structure](https://image.chemsrc.com/caspic/413/66744-30-7.png)
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. 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.
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
Name: GPR151 activator identification: cell-based high-throughput counter-screen assay
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Glucose-dependent insulinotropic receptor; AltName: Full=G-protein coupled receptor 119
External Id: GPR119_PHUNTER_AG_LUMI_1536_3X%ACT CSRUN1
|
|
Name: GPR151 activator identification: cell-based high-throughput confirmation assay
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_3X%ACT CRUN1
|
|
Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)-ethanone |
| 4-chlorophenyl 1,2,4-triazol-1-yl-methyl ketone |
| 2-(1H-1,2,4-triazol-1-yl)-4'-chloroacetophenone |
| 1-(4-CHLOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)-ETHANONE |
| 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)-1-ethanone |
| 4'-chloro-2-(1H-1,2,4-triazol-1-yl)-acetophenone |
| 2-(1,2,4-triazol-1-yl)-4'-chloroacetophenone |
| p-chlorophenacyl-1H-1,2,4-triazole |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: LogP of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is 1.81440. |
| Q: What is the molecular weight of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Molecular weight of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is 221.64300. |
| Q: What is the English name of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: The English name of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone. |
| Q: What is the polar surface area (PSA) of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Polar surface area (PSA) of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is 47.78000. |
| Q: What is the SMILES notation of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: SMILES notation of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is O=C(Cn1cncn1)c1ccc(Cl)cc1. |
| Q: What is the CAS number of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: CAS number of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is 58905-19-4. |
| Q: What English synonyms does 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone have? |
| A: English synonyms of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone: 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)-ethanone, 4-chlorophenyl 1,2,4-triazol-1-yl-methyl ketone, 2-(1H-1,2,4-triazol-1-yl)-4'-chloroacetophenone, 1-(4-CHLOROPHENYL)-2-(1H-1,2,4-TRIAZOLE-1-YL)-ETHANONE, 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)-1-ethanone, 4'-chloro-2-(1H-1,2,4-triazol-1-yl)-acetophenone, 2-(1,2,4-triazol-1-yl)-4'-chloroacetophenone, p-chlorophenacyl-1H-1,2,4-triazole. |
| Q: What is the InChIKey of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: InChIKey of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is ZDGXDQYBMSMZLC-UHFFFAOYSA-N. |
| Q: What is the molecular formula of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone? |
| A: Molecular formula of 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanone is C10H8ClN3O. |
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. |