ChemicalBook >> CAS DataBase List >>3-Chlorobenzyl cyanide
3-Chlorobenzyl cyanide
- CAS No.
- 1529-41-5
- Chemical Name:
- 3-Chlorobenzyl cyanide
- Synonyms
- Meta Chloro Benzyl Cyanide;3-Chlorobenzyl;3-Chlorobenzyl cyani;3-Chloroacetonitrile;m-Chlorobenzyl nitrile;3-CHLOROBENZYL CYANIDE;LABOTEST-BB LT00159490;M-CHLOROBENZYL CYANIDE;3-ChlorobenzylCyanide99%;3-CHLOROPHENYLACETONITRILE
- CBNumber:
- CB5115138
- Molecular Formula:
- C8H6ClN
- Molecular Weight:
- 151.59
- MDL Number:
- MFCD00001908
- MOL File:
- 1529-41-5.mol
- MSDS File:
- SDS
Last updated:2026-08-25 20:17:46
| Melting point | 11-13 °C(lit.) |
|---|---|
| Boiling point | 134-136 °C10 mm Hg(lit.) |
| Density | 1.283 g/mL at 25 °C(lit.) |
| refractive index |
n |
| Flash point | >230 °F |
| storage temp. | Store at room temperature |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | clear liquid |
| color | Colorless to Light yellow to Light orange |
| Specific Gravity | 1.280~1.282 |
| BRN | 2042965 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| Stability | Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents. |
| InChI | 1S/C8H6ClN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4H2 |
| InChIKey | GTIKLPYCSAMPNG-UHFFFAOYSA-N |
| SMILES | Clc1cccc(CC#N)c1 |
| CAS DataBase Reference | 1529-41-5(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | P8K3M9GKQ5 |
| NIST Chemistry Reference | Benzeneacetonitrile, 3-chloro-(1529-41-5) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |  GHS06 |
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|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H301+H311+H331 | |||||||||
| Precautionary statements | P261-P264-P280-P301+P310-P302+P352+P312-P304+P340+P311 | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter | |||||||||
| Hazard Codes | T | |||||||||
| Risk Statements | 23/24/25-36/37/38 | |||||||||
| Safety Statements | 36/37/39-45-28B | |||||||||
| RIDADR | UN 3276 6.1/PG 1 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | AL8240000 | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | II | |||||||||
| HS Code | 29269090 | |||||||||
| Storage Class | 6.1A - Combustible acute toxic Cat. 1 and 2 very toxic hazardous materials |
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| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Inhalation Acute Tox. 3 Oral |
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| Toxicity | mouse,LD50,intraperitoneal,38mg/kg (38mg/kg),PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGEBEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Pesticide Biochemistry and Physiology. Vol. 2, Pg. 95, 1972. | |||||||||
| Limited Quantities | 100ml (liquid) or 0.5 Kg (solid) | |||||||||
| Excepted Quantities | Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml) | |||||||||
| NFPA 704 |
|
3-Chlorobenzyl cyanide price More Price(35)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | C27808 | (3-Chlorophenyl)acetonitrile 99% | 1529-41-5 | 25g | $47.4 | 2023-06-20 | Buy |
| Sigma-Aldrich | C27808 | (3-Chlorophenyl)acetonitrile 99% | 1529-41-5 | 100g | $168 | 2023-06-20 | Buy |
| TCI Chemical | C1091 | 3-Chlorobenzyl Cyanide >98.0%(GC) | 1529-41-5 | 25g | $70 | 2026-04-30 | Buy |
| TRC | TRC-C364455-50G | 3-Chlorobenzyl Cyanide | 1529-41-5 | 50g | $269 | 2026-06-03 | Buy |
| TRC | TRC-C364455-1G | 3-Chlorobenzyl Cyanide | 1529-41-5 | 1g | $154 | 2026-06-03 | Buy |
3-Chlorobenzyl cyanide Chemical Properties, Uses, Production
Chemical Properties
colourless liquid
Uses
3-Chlorobenzyl Cyanide is a useful synthetic intermediate. It was used to design EGFR Tyrosine Kinase Inhibitors. It can also be used to synthesize imidoyl thioureas as non-nucleoside reverse transcriptase inhibitors.
Synthesis
773837-37-9
620-20-2
1529-41-5
GENERAL METHOD: 3-chlorobenzyl chloride (1.0 mmol) and sodium cyanide (2 mmol) were dissolved in water (5 mL) and polyethylene glycol modified diisocyanate (PEG-MDIL, 0.2 g) was added. The reaction suspension was magnetically stirred under reflux conditions for the reaction time shown in Table 2. After completion of the reaction, the mixture was extracted with ether (2 × 10 mL). The organic extracts were combined and dried with anhydrous calcium chloride and subsequently concentrated under reduced pressure. By this method, the target product 3-chlorobenzeneacetonitrile was obtained in good to excellent yields (Scheme 3).
References
[1] Journal of Molecular Liquids, 2015, vol. 202, p. 34 - 39
3-Chlorobenzyl cyanide Preparation Products And Raw materials
Global Suppliers ( 407)
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| PureChemland Co.,Ltd. | 13540909846 13882008651 | 3848291069@qq.com | China | 3000 | 58 |
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| Shanghai Boyle Chemical Co., Ltd. | 021-50182298 021-50180596 | sales@boylechem.com | China | 2202 | 55 |
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| TCI (Shanghai) Development Co., Ltd. | 021-67121386 | Sales-CN@TCIchemicals.com | China | 24512 | 81 |
View Latest Price from 3-Chlorobenzyl cyanide manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2026-09-02 | 3-Chlorobenzyl cyanide
1529-41-5
|
$5.00 | 1KG | 99% | Henan Fengda Chemical Co., Ltd | ||
 |
2026-06-08 | 3-Chlorobenzyl cyanide
1529-41-5
|
1kg | 99% | 1 | Jinan Ruitong Biotech Co., Ltd. | ||
 |
2026-05-28 | 3-Chlorobenzyl cyanide
1529-41-5
|
$10.00 | 1KG | 99.% | 10 ton | Hebei Chuanghai Biotechnology Co,.LTD |
-
- 3-Chlorobenzyl cyanide
1529-41-5
- $5.00
- 99%
- Henan Fengda Chemical Co., Ltd
-
- 3-Chlorobenzyl cyanide
1529-41-5
- 99%
- Jinan Ruitong Biotech Co., Ltd.
-
- 3-Chlorobenzyl cyanide
1529-41-5
- $10.00
- 99.%
- Hebei Chuanghai Biotechnology Co,.LTD
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ARYL ISOCYANATE
Cyanides/Nitriles
Nitrogen Compounds
Organic Building Blocks
C8 to C9
Building Blocks
Aromatic Nitriles
john's
