CAS Number613-90-1
SynonymsMFCD00001837; Benzoyl nitrile; Benzoyl cyanide; Phenylglyoxylonitrile; α-Oxobenzeneacetonitrile; Oxo(phenyl)acetonitrile; Glyoxylonitrile,phenyl; benzoyl cianide; 2-oxo-2-phenylethanenitrile; 2-oxo-2-phenylacetonitrile; EINECS 210-359-7
Molecular FormulaC8H5NO
Molecular Weight131.131
Purity98%
Density1.1±0.1 g/cm3
Boiling Point206.0±9.0 °C at 760 mmHg
Melting Point28-31 °C(lit.)
Appearanceyellow solid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 613-90-1 |
| Catalog No. | 2A-9007163 |
| Chinese Name | 苯甲酰腈 |
| Synonyms | MFCD00001837; Benzoyl nitrile; Benzoyl cyanide; Phenylglyoxylonitrile; α-Oxobenzeneacetonitrile; Oxo(phenyl)acetonitrile; Glyoxylonitrile,phenyl; benzoyl cianide; 2-oxo-2-phenylethanenitrile; 2-oxo-2-phenylacetonitrile; EINECS 210-359-7 |
| Molecular Formula | C8H5NO |
| Molecular Weight | 131.131 |
| Purity | 98 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 206.0±9.0 °C at 760 mmHg |
| Melting Point | 28-31 °C(lit.) |
| Appearance | yellow solid |
| Water Solubility | slihtly soluble, decomposes |
| Storage Condition | Room Temperature |
| Packaging | III |
| HTC | 29269095 |
| UN(IATA) | S26;S29;S36/37/39;S45;S61 |
| SMILES | N#CC(=O)c1ccccc1 |
| InChI | InChI=1S/C8H5NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5H |
| InChI Key | GJQBHOAJJGIPRH-UHFFFAOYSA-N |
| Hazard Symbols | 6.1(b) |
| Risk Codes | T;N |
| Safety Description | 210-359-7 |
| COA | UN3439 6.1/PG 2 |
| MSDS | msds/7163_2_613_90_1.pdf |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 3439 International Dangerous Regulations for sea transport: 3439 International Dangerous Regulations for air transport: 3439 14.2 United Nations shipping name European Land Transport Dangerous Regulations: NITRILES, TOXIC, SOLID, N.O.S. (Benzoyl cyanide) IMDG Code: NITRILES, TOXIC, SOLID, N.O.S. (Benzoyl cyanide) International air transport hazard regulations: Nitriles, solid, toxic, n.o.s. (Benzoyl cyanide) 14.3 Transport hazard categories European Land Transport Danger Regulations: 6.1 International Maritime Transport Danger Regulations: 6.1 International Air Transport Danger Regulations: 6.1 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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