- Benzoyl cyanide
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-
2026-08-07
- CAS:613-90-1
- Min. Order: 1kg
- Purity: 98%
- Supply Ability: 1000
- Benzoyl cyanide
-
-
2019-11-20
- CAS:613-90-1
- Min. Order: 1g
- Purity: 95%min
- Supply Ability: 20kg/month
- Benzoyl cyanide
-
- $1.00
-
2019-08-30
- CAS:613-90-1
- Min. Order: 1KG
- Purity: 98%
- Supply Ability: 200kg
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| | Benzoyl cyanide Basic information |
| Product Name: | Benzoyl cyanide | | Synonyms: | BENZOYL CYANIDE;PHENYLGLYOXYLONITRILE;alpha-oxophenylacetonitrile;Benzoyl cyanide, 95% 25GR;Benzeneacetonitrile,a-oxo-;Benzoyl nitrile;Glyoxylonitrile, phenyl-;Oxo(phenyl)acetonitrile | | CAS: | 613-90-1 | | MF: | C8H5NO | | MW: | 131.13 | | EINECS: | 210-359-7 | | Product Categories: | | | Mol File: | 613-90-1.mol |  |
| | Benzoyl cyanide Chemical Properties |
| Melting point | 28-31 °C(lit.) | | Boiling point | 206 °C(lit.) | | density | 1.106 g/mL at 25 °C(lit.) | | refractive index | 1.4700 (estimate) | | Fp | 184 °F | | solubility | soluble in Methanol | | form | powder to lump to clear liquid | | color | White or Colorless to Light yellow | | Water Solubility | slihtly soluble, decomposes | | BRN | 1072101 | | InChI | InChI=1S/C8H5NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H | | InChIKey | GJQBHOAJJGIPRH-UHFFFAOYSA-N | | SMILES | C(C1C=CC=CC=1)(=O)C#N | | CAS DataBase Reference | 613-90-1(CAS DataBase Reference) | | NIST Chemistry Reference | Benzeneacetonitrile, «alpha»-oxo-(613-90-1) | | EPA Substance Registry System | Benzeneacetonitrile, .alpha.-oxo- (613-90-1) |
| Hazard Codes | T,N | | Risk Statements | 25-50-34-24/25-20 | | Safety Statements | 36/37/39-45-61-29-26 | | RIDADR | UN 3439 6.1/PG 2 | | WGK Germany | 3 | | F | 10 | | TSCA | TSCA listed | | HazardClass | 6.1(b) | | PackingGroup | III | | HS Code | 29269095 | | Storage Class | 6.1B - Non-combustible acute toxic Cat. 1 and 2
very toxic hazardous materials | | Hazard Classifications | Acute Tox. 2 Oral |
| | Benzoyl cyanide Usage And Synthesis |
| Chemical Properties | yellow to brown low melting mass. Phenylglyoxylonitrile [613-90-1], benzoyl cyanide, Mr 131.13, mp 34℃, bp 206 – 208℃ (101.3 kPa), bp 96℃ (2 kPa), bp 82℃ (1.2 kPa), n26D 1.5303, can be used for selective reactions at the carbonyl and cyano groups. It is produced from the reaction of benzoyl chloride or benzoic anhydride with sodium cyanide (or hydrogen cyanide in the presence of alkali cyanide) in practically quantitative yield with copper (I) cyanide as catalyst. Benzoyl cyanide is used as an intermediate in the synthesis of plant protection agents. | | uses | Using benzoyl cyanide as an electrophile also gives selective acylation of the 3-position, as does levulinic acid in the presence of DCC.
Benzoyl cyanide is used to study the mechanism of reduction of benzoyl cyanide in acetonitrile, N,N-dimethylformamide and acetonitrile. It undergoes hydrolysis by Rhodococcus sp. CCZU10-1 to form benzoylformic acid. Reagent for selective acylation of amino compounds. | | Preparation | Benzoyl cyanide is prepared by treatment of benzoyl chloride with sodium cyanide under phase-transfer catalytic conditions. This process is also used to convert 4-methyl, 4-methoxy, and 4-chlorobenzoyl chlorides into the corresponding benzoyl cyanides, and similarly cinnamoyl chloride into cinnamoyl cyanide (98%).
 | | Definition | ChEBI: Benzoyl cyanide is an alpha-ketonitrile and an aromatic ketone. It is functionally related to a benzoic acid. | | Synthesis Reference(s) | Synthetic Communications, 15, p. 849, 1985 DOI: 10.1080/00397918508063881 | | General Description | Benzoyl cyanide is used to study the mechanism of reduction of benzoyl cyanide in acetonitrile, N,N-dimethylformamide and acetonitrile. It undergoes hydrolysis by Rhodococcus sp. CCZU10-1 to form benzoylformic acid. |
| | Benzoyl cyanide Preparation Products And Raw materials |
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