1-(4-Chlorophenyl)ethanone
1-(4-Chlorophenyl)ethanone structure
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Common Name | 1-(4-Chlorophenyl)ethanone | ||
|---|---|---|---|---|
| CAS Number | 99-91-2 | Molecular Weight | 154.594 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 237.7±13.0 °C at 760 mmHg | |
| Molecular Formula | C8H7ClO | Melting Point | 74-76 °C(lit.) | |
| MSDS | USA | Flash Point | 107.1±11.0 °C | |
| Symbol |
GHS05, GHS06 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4'-Chloroacetophenone |
|---|---|
| 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 | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 237.7±13.0 °C at 760 mmHg |
| Melting Point | 74-76 °C(lit.) |
| Molecular Formula | C8H7ClO |
| Molecular Weight | 154.594 |
| Flash Point | 107.1±11.0 °C |
| Exact Mass | 154.018539 |
| PSA | 17.07000 |
| LogP | 2.35 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.532 |
| InChIKey | BUZYGTVTZYSBCU-UHFFFAOYSA-N |
| SMILES | CC(=O)c1ccc(Cl)cc1 |
| Water Solubility | 111 mg/L (25 ºC) |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS05, GHS06 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H302-H315-H318-H330-H335 |
| Precautionary Statements | P260-P280-P284-P305 + P351 + P338-P310 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | T+,Xn |
| Risk Phrases | R26;R36/37/38 |
| Safety Phrases | S26-S28-S36/37/39-S45-S28A |
| RIDADR | UN 3416 6.1/PG 2 |
| WGK Germany | 3 |
| RTECS | KM5600000 |
| Packaging Group | II |
| Hazard Class | 6.1 |
| HS Code | 29147090 |
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 | |
|---|---|
| DownStream 10 | |
CAS#:873-73-4
CAS#:99-90-1
CAS#:1712-70-5
CAS#:64-19-7
CAS#:108-90-7
CAS#:3391-10-4
CAS#:14804-61-6
CAS#:536-38-9
CAS#:57845-08-6
CAS#:637-87-6
CAS#:108664-81-9
CAS#:104941-10-8
CAS#:10180-02-6
CAS#:1078-32-6![N-[(E)-1-(4-chlorophenyl)ethylideneamino]-2-[4-[(Z)-(3-methyl-5-oxo-1H-pyrazol-4-ylidene)methyl]phenoxy]acetamide structure](https://image.chemsrc.com/caspic/434/107045-05-6.png)
CAS#:107045-05-6![2-(2-chloroindolo[2,3-b]quinoxalin-6-yl)-N-[(E)-1-(4-chlorophenyl)ethylideneamino]acetamide structure](https://image.chemsrc.com/caspic/181/109322-10-3.png)
CAS#:109322-10-3
CAS#:10359-12-3![1-[2-(4-chlorobenzoyl)prop-2-enyl]pyridin-2-one structure](https://image.chemsrc.com/caspic/156/104941-12-0.png)
CAS#:104941-12-0
CAS#:104890-73-5
CAS#:37592-72-6This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914700090 |
|---|---|
| Summary | HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Screening of microorganisms producing cold-active oxidoreductases to be applied in enantioselective alcohol oxidation. An Antarctic survey.
Mar. Drugs 9 , 889-905, (2011) Several microorganisms were isolated from soil/sediment samples of Antarctic Peninsula. The enrichment technique using (RS)-1-(phenyl)ethanol as a carbon source allowed us to isolate 232 psychrophile/... |
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Thienylhalomethylketones: Irreversible glycogen synthase kinase 3 inhibitors as useful pharmacological tools
Bioorg. Med. Chem. 17 , 6914-25, (2009) Thienylhalomethylketones, whose chemical, biological, and pharmaceutical data are here reported, are the first irreversible inhibitors of GSK-3beta described to date. Their inhibitory activity is like... |
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Optimization of culture conditions to produce high yields of active Acetobacter sp. CCTCC M209061 cells for anti-Prelog reduction of prochiral ketones.
BMC Biotechnol. 11 , 110, (2011) Chiral alcohols are widely used in the synthesis of chiral pharmaceuticals, flavors and functional materials and appropriate whole-cell biocatalysts offer a highly enantioselective, minimally pollutin... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-acetylchlorobenzene |
| P-CHLOROACETOPHENONE |
| MFCD00000622 |
| 1-(4-chlorophenyl)ethan-1-one |
| 1-(4-Chlorophenyl)ethanone |
| EINECS 202-800-7 |
| 4′-Chloroacetophenone |
| CHLOROACETOPHENONE-4 |
| Acetophenone, 4'-chloro- (8CI) |
| 4-Chloroacetophenone |
| 4'-Chloroacetophenone |
| 4-chlorophenyl methyl ketone |
| p-Chloracetophenone |
| usafdo-1 |
| para-chloroacetophenone |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 4'-Chloroacetophenone? |
| A: Molecular weight of 4'-Chloroacetophenone is 154.594. |
| Q: What English synonyms does 4'-Chloroacetophenone have? |
| A: English synonyms of 4'-Chloroacetophenone: 4-acetylchlorobenzene, P-CHLOROACETOPHENONE, MFCD00000622, 1-(4-chlorophenyl)ethan-1-one, 1-(4-Chlorophenyl)ethanone, EINECS 202-800-7, 4′-Chloroacetophenone, CHLOROACETOPHENONE-4, Acetophenone, 4'-chloro- (8CI), 4-Chloroacetophenone, 4'-Chloroacetophenone, 4-chlorophenyl methyl ketone, p-Chloracetophenone, usafdo-1, para-chloroacetophenone. |
| Q: What are the upstream materials of 4'-Chloroacetophenone? |
| A: Related upstream materials(CAS) of 4'-Chloroacetophenone: 873-73-4;99-90-1;1712-70-5;64-19-7;108-90-7;3391-10-4;14804-61-6;536-38-9;57845-08-6;637-87-6. |
| Q: What is the molecular formula of 4'-Chloroacetophenone? |
| A: Molecular formula of 4'-Chloroacetophenone is C8H7ClO. |
| Q: What is the safety information for 4'-Chloroacetophenone? |
| A: Safety information for 4'-Chloroacetophenone: S26-S28-S36/37/39-S45-S28A. |
| Q: What is the SMILES notation of 4'-Chloroacetophenone? |
| A: SMILES notation of 4'-Chloroacetophenone is CC(=O)c1ccc(Cl)cc1. |
| Q: What is the CAS number of 4'-Chloroacetophenone? |
| A: CAS number of 4'-Chloroacetophenone is 99-91-2. |
| Q: What is the polar surface area (PSA) of 4'-Chloroacetophenone? |
| A: Polar surface area (PSA) of 4'-Chloroacetophenone is 17.07000. |
| Q: What is the melting point of 4'-Chloroacetophenone? |
| A: Melting point of 4'-Chloroacetophenone is 74-76 °C(lit.). |
| Q: What is the InChIKey of 4'-Chloroacetophenone? |
| A: InChIKey of 4'-Chloroacetophenone is BUZYGTVTZYSBCU-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. |
| Henan Tianfu Chemical Co., Ltd. |