CAS Number5005-36-7
SynonymsPhenyl(2-pyridinyl)acetonitrile; α-Phenyl-α-(2-pyridyl)acetonitrile; EINECS 225-677-1; 1-(2-Pyridine)Benzylcyamide; ALPHA-PHENYL-2-PYRIDINEACETONITRILE; MFCD00023497; phenyl(pyridin-2-yl)acetonitrile
Molecular FormulaC13H10N2
Molecular Weight194.23
Purity97%
Density1.1±0.1 g/cm3
Boiling Point322.3±27.0 °C at 760 mmHg
Melting Point83-85ºC
AppearanceOff-white crystalline solid
EINECS225-677-1
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 5005-36-7 |
| Catalog No. | 2A-9008667 |
| Chinese Name | 2-苯基-2-(2-吡啶基)乙腈 |
| Synonyms | Phenyl(2-pyridinyl)acetonitrile; α-Phenyl-α-(2-pyridyl)acetonitrile; EINECS 225-677-1; 1-(2-Pyridine)Benzylcyamide; ALPHA-PHENYL-2-PYRIDINEACETONITRILE; MFCD00023497; phenyl(pyridin-2-yl)acetonitrile |
| Molecular Formula | C13H10N2 |
| Molecular Weight | 194.23 |
| Purity | 97 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 322.3±27.0 °C at 760 mmHg |
| Melting Point | 83-85ºC |
| Appearance | Off-white crystalline solid |
| Storage Condition | -20°C Freezer |
| Application | 2-Phenyl-2-(2-pyridyl)acetonitrile was the major metabolite of SC 15396 metabolized by the rat liver homogenate supernatant fraction. SC 15396 is an antigastrin that inhibits gastric secretion. |
| EINECS | 225-677-1 |
| HTC | 2933399090 |
| SMILES | N#CC(c1ccccc1)c1ccccn1 |
| InChI | InChI=1S/C13H10N2/c14-10-12(11-6-2-1-3-7-11)13-8-4-5-9-15-13/h1-9,12H |
| InChI Key | CAXNYFPECZCGFK-UHFFFAOYSA-N |
| Hazard Symbols | Transport |
| Bioactivity | 2-Phenyl-2-(2-pyridyl)acetonitrile is the major metabolite of SC 15396 metabolized by the supernatant fraction of rat liver homogenate. SC 15396 is an antigastrin that inhibits gastric secretion[1]. Related Catalog Research Areas >> Endocrinology References [1]. Gibson MJ, et al. The metabolism of thioamides by the supernatant fraction of rat liver homogenate. J Pharm Pharmacol. 1969 Dec;21:Suppl:195S+. Chemical & Physical Properties Density 1.1±0.1 g/cm3 Boiling Point 322.3±27.0 °C at 760 mmHg Melting Point 83-85ºC Molecular Formula C13H10N2 Molecular Weight 194.23 Flash Point 115.2±8.9 °C Exact Mass 194.084396 PSA 36.68000 LogP 1.81 Vapour Pressure 0.0±0.7 mmHg at 25°C Index of Refraction 1.589 InChIKey CAXNYFPECZCGFK-UHFFFAOYSA-N SMILES N#CC(c1ccccc1)c1ccccn1 Storage condition -20°C Freezer |
| Use of | Properties Name 2-Phenyl-2-(pyridin-2-yl)acetonitrile Synonym More Synonyms Phenyl(2-pyridinyl)acetonitrile Biological Activity Related Catalog Research Areas >> Endocrinology References [1]. Gibson MJ, et al. The metabolism of thioamides by the supernatant fraction of rat liver homogenate. J Pharm Pharmacol. 1969 Dec;21:Suppl:195S+. Chemical & Physical Properties Molecular Formula C13H10N2 Exact Mass 194.084396 PSA 36.68000 Index of Refraction 1.589 InChIKey CAXNYFPECZCGFK-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| 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. (α-Phenylpyridine-2-acetonitrile) IMDG Code: NITRILES, TOXIC, SOLID, N.O.S. (α-Phenylpyridine-2-acetonitrile) International air transport hazard regulations: Nitriles, solid, toxic, n.o.s. (α-Phenylpyridine-2-acetonitrile) 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 Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 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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