4-Cyanobenzoyl chloride
4-Cyanobenzoyl chloride structure
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Common Name | 4-Cyanobenzoyl chloride | ||
|---|---|---|---|---|
| CAS Number | 6068-72-0 | Molecular Weight | 165.577 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 289.5±23.0 °C at 760 mmHg | |
| Molecular Formula | C8H4ClNO | Melting Point | 68-70 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 128.9±22.6 °C | |
| Symbol |
GHS05 |
Signal Word | Danger | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Cyanobenzoyl chloride |
|---|---|
| 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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 289.5±23.0 °C at 760 mmHg |
| Melting Point | 68-70 °C(lit.) |
| Molecular Formula | C8H4ClNO |
| Molecular Weight | 165.577 |
| Flash Point | 128.9±22.6 °C |
| Exact Mass | 164.998138 |
| PSA | 40.86000 |
| LogP | 1.86 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.568 |
| InChIKey | USEDMAWWQDFMFY-UHFFFAOYSA-N |
| SMILES | N#Cc1ccc(C(=O)Cl)cc1 |
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 |
GHS05 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H314 |
| Precautionary Statements | P280-P305 + P351 + P338-P310 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
| Hazard Codes | C:Corrosive; |
| Risk Phrases | R34 |
| Safety Phrases | S26-S36/37/39-S45-S24/25 |
| RIDADR | UN 3261 8/PG 2 |
| WGK Germany | 3 |
| Packaging Group | II |
| Hazard Class | 8 |
| HS Code | 2926909090 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
|---|---|
| DownStream 10 | |
CAS#:619-65-8
CAS#:75-44-5
CAS#:1877-72-1
CAS#:34241-39-9
CAS#:105-07-7
CAS#:79-37-8
CAS#:874-89-5
CAS#:874-86-2
CAS#:107676-58-4
CAS#:49744-93-6![4-[(4-cyanobenzoyl)amino]benzoic acid structure](https://image.chemsrc.com/caspic/405/143330-23-8.png)
CAS#:143330-23-8
CAS#:452929-54-3
CAS#:17930-02-8
CAS#:2246-51-7
CAS#:18693-97-5
CAS#:623-03-0
CAS#:873-74-5
CAS#:24167-50-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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[2 patients with intestinal perforation following coagulation of the tubes by means of laparoscopy].
Ned. Tijdschr. Geneeskd. 119(8) , 304-6, (1975)
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Anion complexation with cyanobenzoyl substituted first and second generation tripodal amide receptors: crystal structure and solution studies.
Dalton Trans. 44 , 15220-31, (2015) Anion complexation properties of two new tripodal amide receptors have been extensively studied here. Two tripodal receptors have been synthesized from the reaction of cyanobenzoyl acid chloride with ... |
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Synthesis of liquid crystals materials derived from oxadiazole, isoxazole and tetrazole heterocycles. dos Santos DR, et al.
ARKIVOC 17 , 157-166, (2008)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-Cyanobenzoylchloride |
| 4-cyanpbenzoyl chloride |
| EINECS 228-005-5 |
| p-CN-Ph-COCl |
| isocyanobenzoic chloride |
| MFCD00001822 |
| 4-Cyanobenzoyl chloride |
| p-cyanobenzoyl chloride |
| para-cyanobenzoyl chloride |
| 4-Chlorobenzonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 4-Cyanobenzoyl chloride? |
| A: Safety information for 4-Cyanobenzoyl chloride: S26-S36/37/39-S45-S24/25. |
| Q: What is the LogP of 4-Cyanobenzoyl chloride? |
| A: LogP of 4-Cyanobenzoyl chloride is 1.86. |
| Q: What are the downstream products of 4-Cyanobenzoyl chloride? |
| A: Related downstream products(CAS) of 4-Cyanobenzoyl chloride: 107676-58-4;49744-93-6;143330-23-8;452929-54-3;17930-02-8;2246-51-7;18693-97-5;623-03-0;873-74-5;24167-50-8. |
| Q: What is the CAS number of 4-Cyanobenzoyl chloride? |
| A: CAS number of 4-Cyanobenzoyl chloride is 6068-72-0. |
| Q: What are the upstream materials of 4-Cyanobenzoyl chloride? |
| A: Related upstream materials(CAS) of 4-Cyanobenzoyl chloride: 619-65-8;75-44-5;1877-72-1;34241-39-9;105-07-7;79-37-8;874-89-5;874-86-2. |
| Q: What is the molecular formula of 4-Cyanobenzoyl chloride? |
| A: Molecular formula of 4-Cyanobenzoyl chloride is C8H4ClNO. |
| Q: What is the English name of 4-Cyanobenzoyl chloride? |
| A: The English name of 4-Cyanobenzoyl chloride is 4-Cyanobenzoyl chloride. |
| Q: What is the melting point of 4-Cyanobenzoyl chloride? |
| A: Melting point of 4-Cyanobenzoyl chloride is 68-70 °C(lit.). |
| Q: What is the polar surface area (PSA) of 4-Cyanobenzoyl chloride? |
| A: Polar surface area (PSA) of 4-Cyanobenzoyl chloride is 40.86000. |
| Q: What is the SMILES notation of 4-Cyanobenzoyl chloride? |
| A: SMILES notation of 4-Cyanobenzoyl chloride is N#Cc1ccc(C(=O)Cl)cc1. |
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. |